USER MOD reduce.3.24.130724 H: found=0, std=0, add=535, rem=0, adj=19 USER MOD reduce.3.24.130724 removed 535 hydrogens (0 hets) USER MOD ----------------------------------------------------------------- USER MOD scores for adjustable sidechains, with "set" totals for H,N and Q USER MOD "o" means original, "f" means flipped, "180deg" is methyl default USER MOD "!" flags a clash with an overlap of 0.40A or greater USER MOD flip categories: "K"=keep, "C"=clashes, "X"=uncertain, "F"=flip USER MOD Set 1.1: A 162 GLN : amide:sc= -0.152 X(o=-1,f=-1.5) USER MOD Set 1.2: A 215 GLN : amide:sc= -0.477 X(o=-1,f=-1.3) USER MOD Set 1.3: A 217 MET CE :methyl -135:sc= -0.413 (180deg=-0.94) USER MOD Single : A 152 LYS NZ :NH3+ -114:sc= -0.43 (180deg=-2.03!) USER MOD Single : A 157 MET CE :methyl -148:sc= -2.49! (180deg=-3.21!) USER MOD Single : A 159 ASN : amide:sc= -4.55! C(o=-4.6!,f=-5.9!) USER MOD Single : A 160 LYS NZ :NH3+ -175:sc= 0.551 (180deg=0.537) USER MOD Single : A 161 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 163 SER OG : rot 180:sc= 0 USER MOD Single : A 176 ASN : amide:sc= -0.0127 K(o=-0.013,f=-5.4!) USER MOD Single : A 180 CYS SG : rot 170:sc= -0.283 USER MOD Single : A 181 THR OG1 : rot 180:sc= -0.119 USER MOD Single : A 190 SER OG : rot 180:sc= 0 USER MOD Single : A 191 LYS NZ :NH3+ 137:sc= -0.0478 (180deg=-0.951) USER MOD Single : A 193 CYS SG : rot 7:sc= 0.651 USER MOD Single : A 197 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD Single : A 198 TYR OH : rot -108:sc= 0.0869 USER MOD Single : A 199 SER OG : rot 180:sc= -0.0394 USER MOD Single : A 200 SER OG : rot 180:sc= 0 USER MOD Single : A 201 HIS : no HD1:sc= 0 X(o=0,f=-0.21) USER MOD Single : A 205 GLN : amide:sc= 0 X(o=0,f=0) USER MOD Single : A 209 ASN : amide:sc= -1.21 K(o=-1.2,f=-3.9!) USER MOD Single : A 212 HIS : no HE2:sc= -1.89! C(o=-1.9!,f=-9.8!) USER MOD Single : A 214 SER OG : rot 113:sc= 0.868 USER MOD Single : A 216 THR OG1 : rot 180:sc= 0 USER MOD Single : A 221 SER OG : rot -24:sc= 0.0321 USER MOD Single : A 222 SER OG : rot 180:sc= 0 USER MOD Single : A 223 SER OG : rot -160:sc= -0.0268 USER MOD Single : A 227 LYS NZ :NH3+ 180:sc= 0 (180deg=0) USER MOD ----------------------------------------------------------------- ATOM 217 N LYS A 152 5.913 2.243 3.049 1.00 0.00 N ATOM 218 CA LYS A 152 4.517 2.627 2.874 1.00 0.00 C ATOM 219 C LYS A 152 3.922 1.964 1.636 1.00 0.00 C ATOM 220 O LYS A 152 4.634 1.662 0.677 1.00 0.00 O ATOM 221 CB LYS A 152 4.397 4.148 2.758 1.00 0.00 C ATOM 222 CG LYS A 152 2.962 4.640 2.675 1.00 0.00 C ATOM 223 CD LYS A 152 2.895 6.095 2.241 1.00 0.00 C ATOM 224 CE LYS A 152 3.523 7.015 3.278 1.00 0.00 C ATOM 225 NZ LYS A 152 4.994 7.140 3.089 1.00 0.00 N ATOM 0 HA LYS A 152 3.960 2.290 3.748 1.00 0.00 H new ATOM 0 HB2 LYS A 152 4.881 4.609 3.619 1.00 0.00 H new ATOM 0 HB3 LYS A 152 4.938 4.480 1.872 1.00 0.00 H new ATOM 0 HG2 LYS A 152 2.405 4.023 1.970 1.00 0.00 H new ATOM 0 HG3 LYS A 152 2.481 4.527 3.646 1.00 0.00 H new ATOM 0 HD2 LYS A 152 3.409 6.215 1.287 1.00 0.00 H new ATOM 0 HD3 LYS A 152 1.855 6.381 2.081 1.00 0.00 H new ATOM 0 HE2 LYS A 152 3.063 8.001 3.214 1.00 0.00 H new ATOM 0 HE3 LYS A 152 3.316 6.631 4.277 1.00 0.00 H new ATOM 0 HZ1 LYS A 152 5.486 6.715 3.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 152 5.275 6.647 2.217 1.00 0.00 H new ATOM 0 HZ3 LYS A 152 5.251 8.145 3.016 1.00 0.00 H new ATOM 239 N LEU A 153 2.613 1.741 1.662 1.00 0.00 N ATOM 240 CA LEU A 153 1.921 1.114 0.541 1.00 0.00 C ATOM 241 C LEU A 153 0.882 2.059 -0.055 1.00 0.00 C ATOM 242 O LEU A 153 0.105 2.681 0.671 1.00 0.00 O ATOM 243 CB LEU A 153 1.248 -0.183 0.992 1.00 0.00 C ATOM 244 CG LEU A 153 2.184 -1.296 1.465 1.00 0.00 C ATOM 245 CD1 LEU A 153 1.391 -2.426 2.103 1.00 0.00 C ATOM 246 CD2 LEU A 153 3.022 -1.817 0.307 1.00 0.00 C ATOM 0 H LEU A 153 2.009 1.985 2.447 1.00 0.00 H new ATOM 0 HA LEU A 153 2.660 0.884 -0.227 1.00 0.00 H new ATOM 0 HB2 LEU A 153 0.557 0.052 1.802 1.00 0.00 H new ATOM 0 HB3 LEU A 153 0.650 -0.565 0.165 1.00 0.00 H new ATOM 0 HG LEU A 153 2.857 -0.883 2.217 1.00 0.00 H new ATOM 0 HD11 LEU A 153 2.074 -3.209 2.433 1.00 0.00 H new ATOM 0 HD12 LEU A 153 0.837 -2.043 2.960 1.00 0.00 H new ATOM 0 HD13 LEU A 153 0.693 -2.838 1.374 1.00 0.00 H new ATOM 0 HD21 LEU A 153 3.682 -2.608 0.663 1.00 0.00 H new ATOM 0 HD22 LEU A 153 2.366 -2.213 -0.468 1.00 0.00 H new ATOM 0 HD23 LEU A 153 3.620 -1.004 -0.104 1.00 0.00 H new ATOM 258 N PHE A 154 0.873 2.161 -1.380 1.00 0.00 N ATOM 259 CA PHE A 154 -0.072 3.029 -2.073 1.00 0.00 C ATOM 260 C PHE A 154 -1.212 2.217 -2.680 1.00 0.00 C ATOM 261 O PHE A 154 -1.002 1.414 -3.589 1.00 0.00 O ATOM 262 CB PHE A 154 0.643 3.824 -3.168 1.00 0.00 C ATOM 263 CG PHE A 154 -0.273 4.718 -3.954 1.00 0.00 C ATOM 264 CD1 PHE A 154 -1.110 5.615 -3.310 1.00 0.00 C ATOM 265 CD2 PHE A 154 -0.298 4.661 -5.339 1.00 0.00 C ATOM 266 CE1 PHE A 154 -1.954 6.437 -4.031 1.00 0.00 C ATOM 267 CE2 PHE A 154 -1.140 5.481 -6.065 1.00 0.00 C ATOM 268 CZ PHE A 154 -1.968 6.372 -5.411 1.00 0.00 C ATOM 0 H PHE A 154 1.509 1.654 -1.995 1.00 0.00 H new ATOM 0 HA PHE A 154 -0.492 3.723 -1.345 1.00 0.00 H new ATOM 0 HB2 PHE A 154 1.427 4.430 -2.713 1.00 0.00 H new ATOM 0 HB3 PHE A 154 1.133 3.129 -3.850 1.00 0.00 H new ATOM 0 HD1 PHE A 154 -1.102 5.672 -2.232 1.00 0.00 H new ATOM 0 HD2 PHE A 154 0.348 3.967 -5.856 1.00 0.00 H new ATOM 0 HE1 PHE A 154 -2.603 7.130 -3.516 1.00 0.00 H new ATOM 0 HE2 PHE A 154 -1.151 5.425 -7.144 1.00 0.00 H new ATOM 0 HZ PHE A 154 -2.625 7.016 -5.977 1.00 0.00 H new ATOM 278 N VAL A 155 -2.421 2.432 -2.170 1.00 0.00 N ATOM 279 CA VAL A 155 -3.595 1.722 -2.661 1.00 0.00 C ATOM 280 C VAL A 155 -4.506 2.650 -3.456 1.00 0.00 C ATOM 281 O VAL A 155 -5.124 3.557 -2.900 1.00 0.00 O ATOM 282 CB VAL A 155 -4.399 1.098 -1.504 1.00 0.00 C ATOM 283 CG1 VAL A 155 -5.540 0.250 -2.043 1.00 0.00 C ATOM 284 CG2 VAL A 155 -3.488 0.274 -0.607 1.00 0.00 C ATOM 0 H VAL A 155 -2.612 3.093 -1.417 1.00 0.00 H new ATOM 0 HA VAL A 155 -3.234 0.926 -3.313 1.00 0.00 H new ATOM 0 HB VAL A 155 -4.828 1.903 -0.907 1.00 0.00 H new ATOM 0 HG11 VAL A 155 -6.096 -0.182 -1.211 1.00 0.00 H new ATOM 0 HG12 VAL A 155 -6.206 0.873 -2.640 1.00 0.00 H new ATOM 0 HG13 VAL A 155 -5.137 -0.550 -2.665 1.00 0.00 H new ATOM 0 HG21 VAL A 155 -4.072 -0.159 0.205 1.00 0.00 H new ATOM 0 HG22 VAL A 155 -3.029 -0.524 -1.190 1.00 0.00 H new ATOM 0 HG23 VAL A 155 -2.710 0.914 -0.192 1.00 0.00 H new ATOM 294 N GLY A 156 -4.586 2.416 -4.763 1.00 0.00 N ATOM 295 CA GLY A 156 -5.425 3.239 -5.614 1.00 0.00 C ATOM 296 C GLY A 156 -6.622 2.483 -6.154 1.00 0.00 C ATOM 297 O GLY A 156 -7.003 1.444 -5.616 1.00 0.00 O ATOM 0 H GLY A 156 -4.085 1.671 -5.247 1.00 0.00 H new ATOM 0 HA2 GLY A 156 -5.771 4.105 -5.050 1.00 0.00 H new ATOM 0 HA3 GLY A 156 -4.832 3.617 -6.447 1.00 0.00 H new ATOM 301 N MET A 157 -7.219 3.006 -7.220 1.00 0.00 N ATOM 302 CA MET A 157 -8.381 2.373 -7.832 1.00 0.00 C ATOM 303 C MET A 157 -9.403 1.971 -6.773 1.00 0.00 C ATOM 304 O MET A 157 -9.989 0.890 -6.840 1.00 0.00 O ATOM 305 CB MET A 157 -7.954 1.144 -8.638 1.00 0.00 C ATOM 306 CG MET A 157 -7.224 1.486 -9.926 1.00 0.00 C ATOM 307 SD MET A 157 -8.285 2.315 -11.126 1.00 0.00 S ATOM 308 CE MET A 157 -9.612 1.123 -11.285 1.00 0.00 C ATOM 0 H MET A 157 -6.917 3.866 -7.678 1.00 0.00 H new ATOM 0 HA MET A 157 -8.845 3.096 -8.503 1.00 0.00 H new ATOM 0 HB2 MET A 157 -7.309 0.520 -8.019 1.00 0.00 H new ATOM 0 HB3 MET A 157 -8.837 0.551 -8.877 1.00 0.00 H new ATOM 0 HG2 MET A 157 -6.372 2.126 -9.697 1.00 0.00 H new ATOM 0 HG3 MET A 157 -6.827 0.572 -10.368 1.00 0.00 H new ATOM 0 HE1 MET A 157 -10.011 1.156 -12.299 1.00 0.00 H new ATOM 0 HE2 MET A 157 -9.230 0.123 -11.078 1.00 0.00 H new ATOM 0 HE3 MET A 157 -10.404 1.363 -10.575 1.00 0.00 H new ATOM 318 N LEU A 158 -9.611 2.847 -5.796 1.00 0.00 N ATOM 319 CA LEU A 158 -10.562 2.584 -4.722 1.00 0.00 C ATOM 320 C LEU A 158 -11.886 3.296 -4.980 1.00 0.00 C ATOM 321 O LEU A 158 -11.996 4.112 -5.894 1.00 0.00 O ATOM 322 CB LEU A 158 -9.982 3.031 -3.380 1.00 0.00 C ATOM 323 CG LEU A 158 -8.868 2.157 -2.805 1.00 0.00 C ATOM 324 CD1 LEU A 158 -8.370 2.725 -1.485 1.00 0.00 C ATOM 325 CD2 LEU A 158 -9.353 0.726 -2.623 1.00 0.00 C ATOM 0 H LEU A 158 -9.134 3.746 -5.726 1.00 0.00 H new ATOM 0 HA LEU A 158 -10.749 1.511 -4.690 1.00 0.00 H new ATOM 0 HB2 LEU A 158 -9.599 4.045 -3.492 1.00 0.00 H new ATOM 0 HB3 LEU A 158 -10.793 3.075 -2.653 1.00 0.00 H new ATOM 0 HG LEU A 158 -8.037 2.151 -3.510 1.00 0.00 H new ATOM 0 HD11 LEU A 158 -7.577 2.089 -1.091 1.00 0.00 H new ATOM 0 HD12 LEU A 158 -7.982 3.731 -1.645 1.00 0.00 H new ATOM 0 HD13 LEU A 158 -9.193 2.763 -0.771 1.00 0.00 H new ATOM 0 HD21 LEU A 158 -8.547 0.118 -2.213 1.00 0.00 H new ATOM 0 HD22 LEU A 158 -10.201 0.714 -1.939 1.00 0.00 H new ATOM 0 HD23 LEU A 158 -9.659 0.320 -3.587 1.00 0.00 H new ATOM 337 N ASN A 159 -12.889 2.983 -4.166 1.00 0.00 N ATOM 338 CA ASN A 159 -14.206 3.595 -4.305 1.00 0.00 C ATOM 339 C ASN A 159 -14.526 4.476 -3.102 1.00 0.00 C ATOM 340 O ASN A 159 -13.799 4.478 -2.108 1.00 0.00 O ATOM 341 CB ASN A 159 -15.279 2.515 -4.461 1.00 0.00 C ATOM 342 CG ASN A 159 -15.059 1.654 -5.690 1.00 0.00 C ATOM 343 OD1 ASN A 159 -14.567 0.530 -5.594 1.00 0.00 O ATOM 344 ND2 ASN A 159 -15.423 2.180 -6.853 1.00 0.00 N ATOM 0 H ASN A 159 -12.815 2.310 -3.404 1.00 0.00 H new ATOM 0 HA ASN A 159 -14.197 4.220 -5.198 1.00 0.00 H new ATOM 0 HB2 ASN A 159 -15.285 1.882 -3.574 1.00 0.00 H new ATOM 0 HB3 ASN A 159 -16.260 2.987 -4.522 1.00 0.00 H new ATOM 0 HD21 ASN A 159 -15.299 1.648 -7.714 1.00 0.00 H new ATOM 0 HD22 ASN A 159 -15.827 3.116 -6.885 1.00 0.00 H new ATOM 351 N LYS A 160 -15.620 5.224 -3.198 1.00 0.00 N ATOM 352 CA LYS A 160 -16.039 6.109 -2.118 1.00 0.00 C ATOM 353 C LYS A 160 -17.021 5.405 -1.187 1.00 0.00 C ATOM 354 O LYS A 160 -18.020 5.989 -0.767 1.00 0.00 O ATOM 355 CB LYS A 160 -16.681 7.376 -2.689 1.00 0.00 C ATOM 356 CG LYS A 160 -15.719 8.237 -3.489 1.00 0.00 C ATOM 357 CD LYS A 160 -16.460 9.177 -4.425 1.00 0.00 C ATOM 358 CE LYS A 160 -15.509 9.859 -5.397 1.00 0.00 C ATOM 359 NZ LYS A 160 -14.732 10.947 -4.742 1.00 0.00 N ATOM 0 H LYS A 160 -16.233 5.235 -4.013 1.00 0.00 H new ATOM 0 HA LYS A 160 -15.154 6.384 -1.544 1.00 0.00 H new ATOM 0 HB2 LYS A 160 -17.519 7.093 -3.327 1.00 0.00 H new ATOM 0 HB3 LYS A 160 -17.089 7.967 -1.870 1.00 0.00 H new ATOM 0 HG2 LYS A 160 -15.095 8.817 -2.808 1.00 0.00 H new ATOM 0 HG3 LYS A 160 -15.051 7.598 -4.067 1.00 0.00 H new ATOM 0 HD2 LYS A 160 -17.213 8.619 -4.982 1.00 0.00 H new ATOM 0 HD3 LYS A 160 -16.989 9.931 -3.842 1.00 0.00 H new ATOM 0 HE2 LYS A 160 -14.822 9.121 -5.811 1.00 0.00 H new ATOM 0 HE3 LYS A 160 -16.076 10.270 -6.232 1.00 0.00 H new ATOM 0 HZ1 LYS A 160 -14.159 11.442 -5.455 1.00 0.00 H new ATOM 0 HZ2 LYS A 160 -15.387 11.621 -4.295 1.00 0.00 H new ATOM 0 HZ3 LYS A 160 -14.107 10.540 -4.017 1.00 0.00 H new ATOM 373 N GLN A 161 -16.729 4.148 -0.868 1.00 0.00 N ATOM 374 CA GLN A 161 -17.587 3.365 0.014 1.00 0.00 C ATOM 375 C GLN A 161 -16.798 2.826 1.202 1.00 0.00 C ATOM 376 O GLN A 161 -17.263 2.874 2.341 1.00 0.00 O ATOM 377 CB GLN A 161 -18.225 2.208 -0.756 1.00 0.00 C ATOM 378 CG GLN A 161 -19.396 2.631 -1.629 1.00 0.00 C ATOM 379 CD GLN A 161 -19.806 1.556 -2.617 1.00 0.00 C ATOM 380 OE1 GLN A 161 -20.198 0.456 -2.227 1.00 0.00 O ATOM 381 NE2 GLN A 161 -19.718 1.870 -3.904 1.00 0.00 N ATOM 0 H GLN A 161 -15.906 3.650 -1.207 1.00 0.00 H new ATOM 0 HA GLN A 161 -18.373 4.020 0.390 1.00 0.00 H new ATOM 0 HB2 GLN A 161 -17.467 1.737 -1.382 1.00 0.00 H new ATOM 0 HB3 GLN A 161 -18.565 1.454 -0.046 1.00 0.00 H new ATOM 0 HG2 GLN A 161 -20.247 2.879 -0.994 1.00 0.00 H new ATOM 0 HG3 GLN A 161 -19.130 3.537 -2.173 1.00 0.00 H new ATOM 0 HE21 GLN A 161 -19.388 2.794 -4.182 1.00 0.00 H new ATOM 0 HE22 GLN A 161 -19.981 1.187 -4.615 1.00 0.00 H new ATOM 390 N GLN A 162 -15.602 2.313 0.929 1.00 0.00 N ATOM 391 CA GLN A 162 -14.750 1.764 1.977 1.00 0.00 C ATOM 392 C GLN A 162 -14.346 2.846 2.973 1.00 0.00 C ATOM 393 O GLN A 162 -14.404 4.037 2.668 1.00 0.00 O ATOM 394 CB GLN A 162 -13.501 1.125 1.366 1.00 0.00 C ATOM 395 CG GLN A 162 -13.789 -0.147 0.586 1.00 0.00 C ATOM 396 CD GLN A 162 -12.541 -0.967 0.326 1.00 0.00 C ATOM 397 OE1 GLN A 162 -11.435 -0.571 0.697 1.00 0.00 O ATOM 398 NE2 GLN A 162 -12.711 -2.118 -0.314 1.00 0.00 N ATOM 0 H GLN A 162 -15.202 2.266 -0.008 1.00 0.00 H new ATOM 0 HA GLN A 162 -15.318 1.000 2.508 1.00 0.00 H new ATOM 0 HB2 GLN A 162 -13.021 1.846 0.705 1.00 0.00 H new ATOM 0 HB3 GLN A 162 -12.791 0.900 2.162 1.00 0.00 H new ATOM 0 HG2 GLN A 162 -14.508 -0.752 1.138 1.00 0.00 H new ATOM 0 HG3 GLN A 162 -14.254 0.112 -0.365 1.00 0.00 H new ATOM 0 HE21 GLN A 162 -13.645 -2.408 -0.603 1.00 0.00 H new ATOM 0 HE22 GLN A 162 -11.907 -2.713 -0.516 1.00 0.00 H new ATOM 407 N SER A 163 -13.937 2.423 4.165 1.00 0.00 N ATOM 408 CA SER A 163 -13.527 3.357 5.208 1.00 0.00 C ATOM 409 C SER A 163 -12.202 2.928 5.831 1.00 0.00 C ATOM 410 O SER A 163 -11.661 1.874 5.499 1.00 0.00 O ATOM 411 CB SER A 163 -14.605 3.451 6.289 1.00 0.00 C ATOM 412 OG SER A 163 -15.820 3.948 5.756 1.00 0.00 O ATOM 0 H SER A 163 -13.881 1.440 4.433 1.00 0.00 H new ATOM 0 HA SER A 163 -13.393 4.338 4.752 1.00 0.00 H new ATOM 0 HB2 SER A 163 -14.772 2.467 6.727 1.00 0.00 H new ATOM 0 HB3 SER A 163 -14.263 4.103 7.092 1.00 0.00 H new ATOM 0 HG SER A 163 -16.493 3.997 6.467 1.00 0.00 H new ATOM 418 N GLU A 164 -11.686 3.753 6.736 1.00 0.00 N ATOM 419 CA GLU A 164 -10.424 3.460 7.406 1.00 0.00 C ATOM 420 C GLU A 164 -10.470 2.090 8.078 1.00 0.00 C ATOM 421 O GLU A 164 -9.546 1.289 7.941 1.00 0.00 O ATOM 422 CB GLU A 164 -10.109 4.539 8.443 1.00 0.00 C ATOM 423 CG GLU A 164 -8.621 4.761 8.658 1.00 0.00 C ATOM 424 CD GLU A 164 -8.299 5.243 10.059 1.00 0.00 C ATOM 425 OE1 GLU A 164 -8.605 6.414 10.369 1.00 0.00 O ATOM 426 OE2 GLU A 164 -7.741 4.450 10.845 1.00 0.00 O ATOM 0 H GLU A 164 -12.122 4.630 7.022 1.00 0.00 H new ATOM 0 HA GLU A 164 -9.636 3.450 6.653 1.00 0.00 H new ATOM 0 HB2 GLU A 164 -10.566 5.477 8.129 1.00 0.00 H new ATOM 0 HB3 GLU A 164 -10.568 4.263 9.393 1.00 0.00 H new ATOM 0 HG2 GLU A 164 -8.087 3.830 8.467 1.00 0.00 H new ATOM 0 HG3 GLU A 164 -8.258 5.491 7.934 1.00 0.00 H new ATOM 433 N ASP A 165 -11.552 1.830 8.803 1.00 0.00 N ATOM 434 CA ASP A 165 -11.720 0.558 9.497 1.00 0.00 C ATOM 435 C ASP A 165 -11.665 -0.607 8.514 1.00 0.00 C ATOM 436 O ASP A 165 -10.886 -1.544 8.690 1.00 0.00 O ATOM 437 CB ASP A 165 -13.047 0.539 10.257 1.00 0.00 C ATOM 438 CG ASP A 165 -14.217 0.159 9.370 1.00 0.00 C ATOM 439 OD1 ASP A 165 -14.351 -1.039 9.046 1.00 0.00 O ATOM 440 OD2 ASP A 165 -14.998 1.061 8.999 1.00 0.00 O ATOM 0 H ASP A 165 -12.326 2.483 8.926 1.00 0.00 H new ATOM 0 HA ASP A 165 -10.902 0.449 10.209 1.00 0.00 H new ATOM 0 HB2 ASP A 165 -12.978 -0.167 11.085 1.00 0.00 H new ATOM 0 HB3 ASP A 165 -13.228 1.522 10.691 1.00 0.00 H new ATOM 445 N ASP A 166 -12.498 -0.544 7.481 1.00 0.00 N ATOM 446 CA ASP A 166 -12.544 -1.594 6.471 1.00 0.00 C ATOM 447 C ASP A 166 -11.137 -1.998 6.042 1.00 0.00 C ATOM 448 O ASP A 166 -10.765 -3.169 6.117 1.00 0.00 O ATOM 449 CB ASP A 166 -13.347 -1.127 5.255 1.00 0.00 C ATOM 450 CG ASP A 166 -14.817 -0.937 5.571 1.00 0.00 C ATOM 451 OD1 ASP A 166 -15.441 -1.889 6.084 1.00 0.00 O ATOM 452 OD2 ASP A 166 -15.344 0.164 5.305 1.00 0.00 O ATOM 0 H ASP A 166 -13.151 0.223 7.321 1.00 0.00 H new ATOM 0 HA ASP A 166 -13.035 -2.463 6.909 1.00 0.00 H new ATOM 0 HB2 ASP A 166 -12.933 -0.188 4.888 1.00 0.00 H new ATOM 0 HB3 ASP A 166 -13.242 -1.857 4.452 1.00 0.00 H new ATOM 457 N VAL A 167 -10.358 -1.020 5.590 1.00 0.00 N ATOM 458 CA VAL A 167 -8.991 -1.273 5.149 1.00 0.00 C ATOM 459 C VAL A 167 -8.118 -1.742 6.307 1.00 0.00 C ATOM 460 O VAL A 167 -7.344 -2.689 6.170 1.00 0.00 O ATOM 461 CB VAL A 167 -8.362 -0.015 4.522 1.00 0.00 C ATOM 462 CG1 VAL A 167 -6.880 -0.234 4.257 1.00 0.00 C ATOM 463 CG2 VAL A 167 -9.090 0.364 3.241 1.00 0.00 C ATOM 0 H VAL A 167 -10.650 -0.045 5.520 1.00 0.00 H new ATOM 0 HA VAL A 167 -9.042 -2.059 4.395 1.00 0.00 H new ATOM 0 HB VAL A 167 -8.463 0.810 5.228 1.00 0.00 H new ATOM 0 HG11 VAL A 167 -6.453 0.666 3.814 1.00 0.00 H new ATOM 0 HG12 VAL A 167 -6.371 -0.453 5.196 1.00 0.00 H new ATOM 0 HG13 VAL A 167 -6.753 -1.072 3.571 1.00 0.00 H new ATOM 0 HG21 VAL A 167 -8.632 1.255 2.812 1.00 0.00 H new ATOM 0 HG22 VAL A 167 -9.023 -0.458 2.528 1.00 0.00 H new ATOM 0 HG23 VAL A 167 -10.138 0.566 3.464 1.00 0.00 H new ATOM 473 N ARG A 168 -8.248 -1.073 7.448 1.00 0.00 N ATOM 474 CA ARG A 168 -7.469 -1.421 8.630 1.00 0.00 C ATOM 475 C ARG A 168 -7.530 -2.921 8.899 1.00 0.00 C ATOM 476 O ARG A 168 -6.499 -3.587 8.995 1.00 0.00 O ATOM 477 CB ARG A 168 -7.983 -0.652 9.849 1.00 0.00 C ATOM 478 CG ARG A 168 -7.298 0.688 10.057 1.00 0.00 C ATOM 479 CD ARG A 168 -7.642 1.286 11.413 1.00 0.00 C ATOM 480 NE ARG A 168 -6.906 0.642 12.497 1.00 0.00 N ATOM 481 CZ ARG A 168 -6.993 1.017 13.769 1.00 0.00 C ATOM 482 NH1 ARG A 168 -7.781 2.026 14.113 1.00 0.00 N ATOM 483 NH2 ARG A 168 -6.291 0.382 14.698 1.00 0.00 N ATOM 0 H ARG A 168 -8.885 -0.287 7.579 1.00 0.00 H new ATOM 0 HA ARG A 168 -6.431 -1.145 8.445 1.00 0.00 H new ATOM 0 HB2 ARG A 168 -9.055 -0.489 9.740 1.00 0.00 H new ATOM 0 HB3 ARG A 168 -7.843 -1.264 10.740 1.00 0.00 H new ATOM 0 HG2 ARG A 168 -6.218 0.562 9.977 1.00 0.00 H new ATOM 0 HG3 ARG A 168 -7.598 1.377 9.268 1.00 0.00 H new ATOM 0 HD2 ARG A 168 -7.418 2.353 11.406 1.00 0.00 H new ATOM 0 HD3 ARG A 168 -8.713 1.186 11.592 1.00 0.00 H new ATOM 0 HE ARG A 168 -6.291 -0.138 12.265 1.00 0.00 H new ATOM 0 HH11 ARG A 168 -8.322 2.516 13.401 1.00 0.00 H new ATOM 0 HH12 ARG A 168 -7.846 2.312 15.090 1.00 0.00 H new ATOM 0 HH21 ARG A 168 -5.684 -0.395 14.436 1.00 0.00 H new ATOM 0 HH22 ARG A 168 -6.358 0.670 15.674 1.00 0.00 H new ATOM 497 N ARG A 169 -8.745 -3.447 9.019 1.00 0.00 N ATOM 498 CA ARG A 169 -8.940 -4.868 9.279 1.00 0.00 C ATOM 499 C ARG A 169 -8.577 -5.700 8.052 1.00 0.00 C ATOM 500 O ARG A 169 -7.817 -6.665 8.145 1.00 0.00 O ATOM 501 CB ARG A 169 -10.390 -5.141 9.682 1.00 0.00 C ATOM 502 CG ARG A 169 -10.764 -4.566 11.038 1.00 0.00 C ATOM 503 CD ARG A 169 -12.253 -4.705 11.311 1.00 0.00 C ATOM 504 NE ARG A 169 -12.544 -4.770 12.741 1.00 0.00 N ATOM 505 CZ ARG A 169 -13.698 -5.202 13.237 1.00 0.00 C ATOM 506 NH1 ARG A 169 -14.664 -5.606 12.424 1.00 0.00 N ATOM 507 NH2 ARG A 169 -13.887 -5.232 14.550 1.00 0.00 N ATOM 0 H ARG A 169 -9.609 -2.910 8.940 1.00 0.00 H new ATOM 0 HA ARG A 169 -8.282 -5.155 10.099 1.00 0.00 H new ATOM 0 HB2 ARG A 169 -11.053 -4.724 8.924 1.00 0.00 H new ATOM 0 HB3 ARG A 169 -10.558 -6.218 9.695 1.00 0.00 H new ATOM 0 HG2 ARG A 169 -10.201 -5.077 11.819 1.00 0.00 H new ATOM 0 HG3 ARG A 169 -10.482 -3.514 11.078 1.00 0.00 H new ATOM 0 HD2 ARG A 169 -12.783 -3.860 10.871 1.00 0.00 H new ATOM 0 HD3 ARG A 169 -12.628 -5.605 10.823 1.00 0.00 H new ATOM 0 HE ARG A 169 -11.822 -4.467 13.394 1.00 0.00 H new ATOM 0 HH11 ARG A 169 -14.522 -5.586 11.414 1.00 0.00 H new ATOM 0 HH12 ARG A 169 -15.549 -5.937 12.808 1.00 0.00 H new ATOM 0 HH21 ARG A 169 -13.146 -4.923 15.179 1.00 0.00 H new ATOM 0 HH22 ARG A 169 -14.773 -5.564 14.930 1.00 0.00 H new ATOM 521 N LEU A 170 -9.124 -5.319 6.903 1.00 0.00 N ATOM 522 CA LEU A 170 -8.859 -6.030 5.657 1.00 0.00 C ATOM 523 C LEU A 170 -7.363 -6.266 5.472 1.00 0.00 C ATOM 524 O LEU A 170 -6.903 -7.408 5.450 1.00 0.00 O ATOM 525 CB LEU A 170 -9.412 -5.240 4.469 1.00 0.00 C ATOM 526 CG LEU A 170 -9.590 -6.023 3.167 1.00 0.00 C ATOM 527 CD1 LEU A 170 -10.873 -6.839 3.207 1.00 0.00 C ATOM 528 CD2 LEU A 170 -9.593 -5.079 1.974 1.00 0.00 C ATOM 0 H LEU A 170 -9.754 -4.522 6.808 1.00 0.00 H new ATOM 0 HA LEU A 170 -9.358 -6.998 5.707 1.00 0.00 H new ATOM 0 HB2 LEU A 170 -10.378 -4.823 4.754 1.00 0.00 H new ATOM 0 HB3 LEU A 170 -8.746 -4.399 4.276 1.00 0.00 H new ATOM 0 HG LEU A 170 -8.750 -6.709 3.060 1.00 0.00 H new ATOM 0 HD11 LEU A 170 -10.983 -7.389 2.273 1.00 0.00 H new ATOM 0 HD12 LEU A 170 -10.832 -7.541 4.039 1.00 0.00 H new ATOM 0 HD13 LEU A 170 -11.725 -6.172 3.338 1.00 0.00 H new ATOM 0 HD21 LEU A 170 -9.721 -5.653 1.056 1.00 0.00 H new ATOM 0 HD22 LEU A 170 -10.413 -4.368 2.074 1.00 0.00 H new ATOM 0 HD23 LEU A 170 -8.647 -4.538 1.935 1.00 0.00 H new ATOM 540 N PHE A 171 -6.609 -5.179 5.343 1.00 0.00 N ATOM 541 CA PHE A 171 -5.165 -5.268 5.163 1.00 0.00 C ATOM 542 C PHE A 171 -4.527 -6.089 6.279 1.00 0.00 C ATOM 543 O PHE A 171 -3.872 -7.099 6.024 1.00 0.00 O ATOM 544 CB PHE A 171 -4.547 -3.869 5.126 1.00 0.00 C ATOM 545 CG PHE A 171 -4.683 -3.189 3.793 1.00 0.00 C ATOM 546 CD1 PHE A 171 -5.931 -2.997 3.223 1.00 0.00 C ATOM 547 CD2 PHE A 171 -3.563 -2.740 3.112 1.00 0.00 C ATOM 548 CE1 PHE A 171 -6.059 -2.372 1.997 1.00 0.00 C ATOM 549 CE2 PHE A 171 -3.685 -2.114 1.886 1.00 0.00 C ATOM 550 CZ PHE A 171 -4.934 -1.929 1.328 1.00 0.00 C ATOM 0 H PHE A 171 -6.974 -4.227 5.360 1.00 0.00 H new ATOM 0 HA PHE A 171 -4.973 -5.768 4.214 1.00 0.00 H new ATOM 0 HB2 PHE A 171 -5.019 -3.251 5.890 1.00 0.00 H new ATOM 0 HB3 PHE A 171 -3.490 -3.940 5.382 1.00 0.00 H new ATOM 0 HD1 PHE A 171 -6.814 -3.340 3.742 1.00 0.00 H new ATOM 0 HD2 PHE A 171 -2.583 -2.881 3.544 1.00 0.00 H new ATOM 0 HE1 PHE A 171 -7.037 -2.230 1.562 1.00 0.00 H new ATOM 0 HE2 PHE A 171 -2.804 -1.770 1.365 1.00 0.00 H new ATOM 0 HZ PHE A 171 -5.032 -1.439 0.371 1.00 0.00 H new ATOM 560 N GLU A 172 -4.723 -5.646 7.517 1.00 0.00 N ATOM 561 CA GLU A 172 -4.165 -6.339 8.673 1.00 0.00 C ATOM 562 C GLU A 172 -4.686 -7.771 8.753 1.00 0.00 C ATOM 563 O GLU A 172 -4.200 -8.576 9.546 1.00 0.00 O ATOM 564 CB GLU A 172 -4.509 -5.587 9.961 1.00 0.00 C ATOM 565 CG GLU A 172 -5.809 -6.041 10.602 1.00 0.00 C ATOM 566 CD GLU A 172 -5.604 -7.154 11.611 1.00 0.00 C ATOM 567 OE1 GLU A 172 -4.509 -7.222 12.207 1.00 0.00 O ATOM 568 OE2 GLU A 172 -6.541 -7.958 11.805 1.00 0.00 O ATOM 0 H GLU A 172 -5.263 -4.811 7.745 1.00 0.00 H new ATOM 0 HA GLU A 172 -3.082 -6.371 8.557 1.00 0.00 H new ATOM 0 HB2 GLU A 172 -3.696 -5.717 10.676 1.00 0.00 H new ATOM 0 HB3 GLU A 172 -4.574 -4.521 9.743 1.00 0.00 H new ATOM 0 HG2 GLU A 172 -6.283 -5.192 11.094 1.00 0.00 H new ATOM 0 HG3 GLU A 172 -6.493 -6.382 9.825 1.00 0.00 H new ATOM 575 N ALA A 173 -5.679 -8.080 7.925 1.00 0.00 N ATOM 576 CA ALA A 173 -6.265 -9.414 7.900 1.00 0.00 C ATOM 577 C ALA A 173 -5.228 -10.463 7.511 1.00 0.00 C ATOM 578 O ALA A 173 -5.473 -11.664 7.623 1.00 0.00 O ATOM 579 CB ALA A 173 -7.444 -9.455 6.939 1.00 0.00 C ATOM 0 H ALA A 173 -6.094 -7.424 7.263 1.00 0.00 H new ATOM 0 HA ALA A 173 -6.620 -9.646 8.904 1.00 0.00 H new ATOM 0 HB1 ALA A 173 -7.872 -10.457 6.931 1.00 0.00 H new ATOM 0 HB2 ALA A 173 -8.201 -8.740 7.261 1.00 0.00 H new ATOM 0 HB3 ALA A 173 -7.105 -9.197 5.936 1.00 0.00 H new ATOM 585 N PHE A 174 -4.069 -10.000 7.053 1.00 0.00 N ATOM 586 CA PHE A 174 -2.995 -10.899 6.646 1.00 0.00 C ATOM 587 C PHE A 174 -1.736 -10.650 7.472 1.00 0.00 C ATOM 588 O PHE A 174 -1.327 -11.492 8.270 1.00 0.00 O ATOM 589 CB PHE A 174 -2.687 -10.719 5.158 1.00 0.00 C ATOM 590 CG PHE A 174 -3.843 -11.057 4.262 1.00 0.00 C ATOM 591 CD1 PHE A 174 -4.841 -10.127 4.015 1.00 0.00 C ATOM 592 CD2 PHE A 174 -3.933 -12.304 3.665 1.00 0.00 C ATOM 593 CE1 PHE A 174 -5.906 -10.435 3.190 1.00 0.00 C ATOM 594 CE2 PHE A 174 -4.996 -12.617 2.839 1.00 0.00 C ATOM 595 CZ PHE A 174 -5.984 -11.682 2.602 1.00 0.00 C ATOM 0 H PHE A 174 -3.850 -9.009 6.955 1.00 0.00 H new ATOM 0 HA PHE A 174 -3.326 -11.923 6.820 1.00 0.00 H new ATOM 0 HB2 PHE A 174 -2.389 -9.686 4.979 1.00 0.00 H new ATOM 0 HB3 PHE A 174 -1.836 -11.347 4.893 1.00 0.00 H new ATOM 0 HD1 PHE A 174 -4.786 -9.150 4.473 1.00 0.00 H new ATOM 0 HD2 PHE A 174 -3.164 -13.040 3.847 1.00 0.00 H new ATOM 0 HE1 PHE A 174 -6.677 -9.701 3.005 1.00 0.00 H new ATOM 0 HE2 PHE A 174 -5.054 -13.592 2.379 1.00 0.00 H new ATOM 0 HZ PHE A 174 -6.816 -11.925 1.958 1.00 0.00 H new ATOM 605 N GLY A 175 -1.124 -9.486 7.272 1.00 0.00 N ATOM 606 CA GLY A 175 0.082 -9.147 8.003 1.00 0.00 C ATOM 607 C GLY A 175 -0.143 -8.034 9.007 1.00 0.00 C ATOM 608 O GLY A 175 -1.273 -7.596 9.216 1.00 0.00 O ATOM 0 H GLY A 175 -1.443 -8.772 6.617 1.00 0.00 H new ATOM 0 HA2 GLY A 175 0.449 -10.032 8.522 1.00 0.00 H new ATOM 0 HA3 GLY A 175 0.858 -8.846 7.299 1.00 0.00 H new ATOM 612 N ASN A 176 0.937 -7.575 9.632 1.00 0.00 N ATOM 613 CA ASN A 176 0.852 -6.508 10.622 1.00 0.00 C ATOM 614 C ASN A 176 0.850 -5.139 9.948 1.00 0.00 C ATOM 615 O ASN A 176 1.414 -4.968 8.867 1.00 0.00 O ATOM 616 CB ASN A 176 2.020 -6.602 11.606 1.00 0.00 C ATOM 617 CG ASN A 176 1.729 -5.900 12.918 1.00 0.00 C ATOM 618 OD1 ASN A 176 0.683 -5.272 13.080 1.00 0.00 O ATOM 619 ND2 ASN A 176 2.657 -6.002 13.862 1.00 0.00 N ATOM 0 H ASN A 176 1.881 -7.926 9.470 1.00 0.00 H new ATOM 0 HA ASN A 176 -0.084 -6.627 11.167 1.00 0.00 H new ATOM 0 HB2 ASN A 176 2.244 -7.651 11.800 1.00 0.00 H new ATOM 0 HB3 ASN A 176 2.909 -6.165 11.153 1.00 0.00 H new ATOM 0 HD21 ASN A 176 2.517 -5.549 14.765 1.00 0.00 H new ATOM 0 HD22 ASN A 176 3.509 -6.533 13.684 1.00 0.00 H new ATOM 626 N ILE A 177 0.212 -4.169 10.593 1.00 0.00 N ATOM 627 CA ILE A 177 0.137 -2.816 10.057 1.00 0.00 C ATOM 628 C ILE A 177 0.743 -1.806 11.026 1.00 0.00 C ATOM 629 O ILE A 177 0.405 -1.788 12.209 1.00 0.00 O ATOM 630 CB ILE A 177 -1.317 -2.410 9.753 1.00 0.00 C ATOM 631 CG1 ILE A 177 -1.841 -3.179 8.538 1.00 0.00 C ATOM 632 CG2 ILE A 177 -1.410 -0.910 9.516 1.00 0.00 C ATOM 633 CD1 ILE A 177 -3.211 -2.728 8.082 1.00 0.00 C ATOM 0 H ILE A 177 -0.261 -4.295 11.488 1.00 0.00 H new ATOM 0 HA ILE A 177 0.708 -2.813 9.128 1.00 0.00 H new ATOM 0 HB ILE A 177 -1.936 -2.662 10.614 1.00 0.00 H new ATOM 0 HG12 ILE A 177 -1.137 -3.064 7.714 1.00 0.00 H new ATOM 0 HG13 ILE A 177 -1.879 -4.241 8.779 1.00 0.00 H new ATOM 0 HG21 ILE A 177 -2.444 -0.639 9.302 1.00 0.00 H new ATOM 0 HG22 ILE A 177 -1.072 -0.379 10.406 1.00 0.00 H new ATOM 0 HG23 ILE A 177 -0.781 -0.636 8.669 1.00 0.00 H new ATOM 0 HD11 ILE A 177 -3.519 -3.316 7.217 1.00 0.00 H new ATOM 0 HD12 ILE A 177 -3.928 -2.869 8.891 1.00 0.00 H new ATOM 0 HD13 ILE A 177 -3.175 -1.673 7.809 1.00 0.00 H new ATOM 645 N GLU A 178 1.638 -0.967 10.515 1.00 0.00 N ATOM 646 CA GLU A 178 2.290 0.046 11.336 1.00 0.00 C ATOM 647 C GLU A 178 1.373 1.247 11.548 1.00 0.00 C ATOM 648 O GLU A 178 1.223 1.735 12.668 1.00 0.00 O ATOM 649 CB GLU A 178 3.598 0.500 10.683 1.00 0.00 C ATOM 650 CG GLU A 178 4.784 -0.392 11.013 1.00 0.00 C ATOM 651 CD GLU A 178 4.901 -0.681 12.497 1.00 0.00 C ATOM 652 OE1 GLU A 178 4.871 0.282 13.292 1.00 0.00 O ATOM 653 OE2 GLU A 178 5.023 -1.868 12.863 1.00 0.00 O ATOM 0 H GLU A 178 1.928 -0.969 9.537 1.00 0.00 H new ATOM 0 HA GLU A 178 2.511 -0.398 12.307 1.00 0.00 H new ATOM 0 HB2 GLU A 178 3.464 0.527 9.602 1.00 0.00 H new ATOM 0 HB3 GLU A 178 3.820 1.518 11.003 1.00 0.00 H new ATOM 0 HG2 GLU A 178 4.689 -1.332 10.470 1.00 0.00 H new ATOM 0 HG3 GLU A 178 5.701 0.085 10.666 1.00 0.00 H new ATOM 660 N GLU A 179 0.762 1.717 10.465 1.00 0.00 N ATOM 661 CA GLU A 179 -0.139 2.862 10.533 1.00 0.00 C ATOM 662 C GLU A 179 -0.974 2.973 9.261 1.00 0.00 C ATOM 663 O GLU A 179 -0.495 2.685 8.164 1.00 0.00 O ATOM 664 CB GLU A 179 0.654 4.152 10.750 1.00 0.00 C ATOM 665 CG GLU A 179 -0.218 5.358 11.055 1.00 0.00 C ATOM 666 CD GLU A 179 -0.577 5.462 12.525 1.00 0.00 C ATOM 667 OE1 GLU A 179 0.173 4.915 13.360 1.00 0.00 O ATOM 668 OE2 GLU A 179 -1.609 6.091 12.839 1.00 0.00 O ATOM 0 H GLU A 179 0.874 1.323 9.531 1.00 0.00 H new ATOM 0 HA GLU A 179 -0.812 2.712 11.377 1.00 0.00 H new ATOM 0 HB2 GLU A 179 1.355 4.004 11.572 1.00 0.00 H new ATOM 0 HB3 GLU A 179 1.247 4.359 9.859 1.00 0.00 H new ATOM 0 HG2 GLU A 179 0.302 6.265 10.747 1.00 0.00 H new ATOM 0 HG3 GLU A 179 -1.133 5.299 10.465 1.00 0.00 H new ATOM 675 N CYS A 180 -2.225 3.391 9.416 1.00 0.00 N ATOM 676 CA CYS A 180 -3.129 3.540 8.281 1.00 0.00 C ATOM 677 C CYS A 180 -3.587 4.987 8.136 1.00 0.00 C ATOM 678 O CYS A 180 -3.810 5.682 9.128 1.00 0.00 O ATOM 679 CB CYS A 180 -4.341 2.622 8.444 1.00 0.00 C ATOM 680 SG CYS A 180 -5.672 2.940 7.262 1.00 0.00 S ATOM 0 H CYS A 180 -2.637 3.633 10.317 1.00 0.00 H new ATOM 0 HA CYS A 180 -2.588 3.258 7.378 1.00 0.00 H new ATOM 0 HB2 CYS A 180 -4.016 1.587 8.339 1.00 0.00 H new ATOM 0 HB3 CYS A 180 -4.733 2.732 9.455 1.00 0.00 H new ATOM 0 HG CYS A 180 -6.554 1.988 7.335 1.00 0.00 H new ATOM 686 N THR A 181 -3.726 5.437 6.893 1.00 0.00 N ATOM 687 CA THR A 181 -4.155 6.803 6.618 1.00 0.00 C ATOM 688 C THR A 181 -4.856 6.897 5.268 1.00 0.00 C ATOM 689 O THR A 181 -4.248 6.658 4.224 1.00 0.00 O ATOM 690 CB THR A 181 -2.964 7.780 6.634 1.00 0.00 C ATOM 691 OG1 THR A 181 -2.230 7.638 7.856 1.00 0.00 O ATOM 692 CG2 THR A 181 -3.441 9.217 6.488 1.00 0.00 C ATOM 0 H THR A 181 -3.548 4.875 6.060 1.00 0.00 H new ATOM 0 HA THR A 181 -4.853 7.080 7.408 1.00 0.00 H new ATOM 0 HB THR A 181 -2.316 7.541 5.791 1.00 0.00 H new ATOM 0 HG1 THR A 181 -1.474 8.261 7.858 1.00 0.00 H new ATOM 0 HG21 THR A 181 -2.583 9.889 6.502 1.00 0.00 H new ATOM 0 HG22 THR A 181 -3.974 9.329 5.544 1.00 0.00 H new ATOM 0 HG23 THR A 181 -4.109 9.464 7.313 1.00 0.00 H new ATOM 700 N ILE A 182 -6.138 7.247 5.295 1.00 0.00 N ATOM 701 CA ILE A 182 -6.921 7.374 4.073 1.00 0.00 C ATOM 702 C ILE A 182 -6.714 8.740 3.427 1.00 0.00 C ATOM 703 O ILE A 182 -6.732 9.769 4.105 1.00 0.00 O ATOM 704 CB ILE A 182 -8.423 7.169 4.342 1.00 0.00 C ATOM 705 CG1 ILE A 182 -8.659 5.830 5.044 1.00 0.00 C ATOM 706 CG2 ILE A 182 -9.209 7.236 3.041 1.00 0.00 C ATOM 707 CD1 ILE A 182 -8.212 4.635 4.232 1.00 0.00 C ATOM 0 H ILE A 182 -6.656 7.448 6.150 1.00 0.00 H new ATOM 0 HA ILE A 182 -6.573 6.596 3.393 1.00 0.00 H new ATOM 0 HB ILE A 182 -8.772 7.968 4.996 1.00 0.00 H new ATOM 0 HG12 ILE A 182 -8.129 5.830 5.997 1.00 0.00 H new ATOM 0 HG13 ILE A 182 -9.721 5.729 5.269 1.00 0.00 H new ATOM 0 HG21 ILE A 182 -10.269 7.089 3.248 1.00 0.00 H new ATOM 0 HG22 ILE A 182 -9.062 8.211 2.577 1.00 0.00 H new ATOM 0 HG23 ILE A 182 -8.860 6.456 2.365 1.00 0.00 H new ATOM 0 HD11 ILE A 182 -8.410 3.721 4.791 1.00 0.00 H new ATOM 0 HD12 ILE A 182 -8.760 4.610 3.290 1.00 0.00 H new ATOM 0 HD13 ILE A 182 -7.144 4.712 4.029 1.00 0.00 H new ATOM 719 N LEU A 183 -6.519 8.744 2.113 1.00 0.00 N ATOM 720 CA LEU A 183 -6.310 9.984 1.374 1.00 0.00 C ATOM 721 C LEU A 183 -7.643 10.632 1.009 1.00 0.00 C ATOM 722 O LEU A 183 -8.317 10.202 0.074 1.00 0.00 O ATOM 723 CB LEU A 183 -5.497 9.716 0.107 1.00 0.00 C ATOM 724 CG LEU A 183 -3.989 9.550 0.299 1.00 0.00 C ATOM 725 CD1 LEU A 183 -3.324 9.153 -1.009 1.00 0.00 C ATOM 726 CD2 LEU A 183 -3.377 10.832 0.843 1.00 0.00 C ATOM 0 H LEU A 183 -6.501 7.902 1.537 1.00 0.00 H new ATOM 0 HA LEU A 183 -5.756 10.670 2.015 1.00 0.00 H new ATOM 0 HB2 LEU A 183 -5.884 8.813 -0.365 1.00 0.00 H new ATOM 0 HB3 LEU A 183 -5.666 10.537 -0.589 1.00 0.00 H new ATOM 0 HG LEU A 183 -3.820 8.754 1.024 1.00 0.00 H new ATOM 0 HD11 LEU A 183 -2.251 9.040 -0.852 1.00 0.00 H new ATOM 0 HD12 LEU A 183 -3.742 8.208 -1.357 1.00 0.00 H new ATOM 0 HD13 LEU A 183 -3.502 9.926 -1.757 1.00 0.00 H new ATOM 0 HD21 LEU A 183 -2.303 10.696 0.974 1.00 0.00 H new ATOM 0 HD22 LEU A 183 -3.557 11.647 0.142 1.00 0.00 H new ATOM 0 HD23 LEU A 183 -3.832 11.073 1.804 1.00 0.00 H new ATOM 816 N SER A 190 -13.300 10.904 0.148 1.00 0.00 N ATOM 817 CA SER A 190 -12.257 9.963 -0.245 1.00 0.00 C ATOM 818 C SER A 190 -11.897 10.135 -1.718 1.00 0.00 C ATOM 819 O SER A 190 -12.773 10.200 -2.580 1.00 0.00 O ATOM 820 CB SER A 190 -12.711 8.526 0.017 1.00 0.00 C ATOM 821 OG SER A 190 -11.697 7.599 -0.330 1.00 0.00 O ATOM 0 HA SER A 190 -11.370 10.171 0.354 1.00 0.00 H new ATOM 0 HB2 SER A 190 -12.970 8.409 1.069 1.00 0.00 H new ATOM 0 HB3 SER A 190 -13.613 8.316 -0.558 1.00 0.00 H new ATOM 0 HG SER A 190 -12.011 6.688 -0.152 1.00 0.00 H new ATOM 827 N LYS A 191 -10.600 10.208 -1.999 1.00 0.00 N ATOM 828 CA LYS A 191 -10.121 10.371 -3.366 1.00 0.00 C ATOM 829 C LYS A 191 -9.791 9.019 -3.992 1.00 0.00 C ATOM 830 O LYS A 191 -8.965 8.929 -4.898 1.00 0.00 O ATOM 831 CB LYS A 191 -8.885 11.272 -3.391 1.00 0.00 C ATOM 832 CG LYS A 191 -9.138 12.668 -2.849 1.00 0.00 C ATOM 833 CD LYS A 191 -10.026 13.475 -3.781 1.00 0.00 C ATOM 834 CE LYS A 191 -9.209 14.207 -4.834 1.00 0.00 C ATOM 835 NZ LYS A 191 -9.015 13.382 -6.058 1.00 0.00 N ATOM 0 H LYS A 191 -9.862 10.157 -1.297 1.00 0.00 H new ATOM 0 HA LYS A 191 -10.915 10.838 -3.949 1.00 0.00 H new ATOM 0 HB2 LYS A 191 -8.092 10.803 -2.808 1.00 0.00 H new ATOM 0 HB3 LYS A 191 -8.523 11.350 -4.416 1.00 0.00 H new ATOM 0 HG2 LYS A 191 -9.607 12.599 -1.867 1.00 0.00 H new ATOM 0 HG3 LYS A 191 -8.188 13.184 -2.713 1.00 0.00 H new ATOM 0 HD2 LYS A 191 -10.740 12.812 -4.269 1.00 0.00 H new ATOM 0 HD3 LYS A 191 -10.604 14.195 -3.202 1.00 0.00 H new ATOM 0 HE2 LYS A 191 -9.710 15.138 -5.099 1.00 0.00 H new ATOM 0 HE3 LYS A 191 -8.237 14.474 -4.419 1.00 0.00 H new ATOM 0 HZ1 LYS A 191 -9.154 13.974 -6.901 1.00 0.00 H new ATOM 0 HZ2 LYS A 191 -8.051 12.991 -6.064 1.00 0.00 H new ATOM 0 HZ3 LYS A 191 -9.704 12.603 -6.065 1.00 0.00 H new ATOM 849 N GLY A 192 -10.445 7.970 -3.502 1.00 0.00 N ATOM 850 CA GLY A 192 -10.208 6.637 -4.026 1.00 0.00 C ATOM 851 C GLY A 192 -8.765 6.201 -3.868 1.00 0.00 C ATOM 852 O GLY A 192 -8.227 5.494 -4.721 1.00 0.00 O ATOM 0 H GLY A 192 -11.134 8.019 -2.752 1.00 0.00 H new ATOM 0 HA2 GLY A 192 -10.857 5.927 -3.513 1.00 0.00 H new ATOM 0 HA3 GLY A 192 -10.479 6.611 -5.082 1.00 0.00 H new ATOM 856 N CYS A 193 -8.137 6.623 -2.777 1.00 0.00 N ATOM 857 CA CYS A 193 -6.746 6.273 -2.511 1.00 0.00 C ATOM 858 C CYS A 193 -6.454 6.301 -1.015 1.00 0.00 C ATOM 859 O CYS A 193 -7.125 6.998 -0.255 1.00 0.00 O ATOM 860 CB CYS A 193 -5.808 7.233 -3.245 1.00 0.00 C ATOM 861 SG CYS A 193 -5.854 7.078 -5.046 1.00 0.00 S ATOM 0 H CYS A 193 -8.569 7.208 -2.062 1.00 0.00 H new ATOM 0 HA CYS A 193 -6.576 5.260 -2.876 1.00 0.00 H new ATOM 0 HB2 CYS A 193 -6.067 8.256 -2.972 1.00 0.00 H new ATOM 0 HB3 CYS A 193 -4.788 7.060 -2.902 1.00 0.00 H new ATOM 0 HG CYS A 193 -6.802 6.256 -5.387 1.00 0.00 H new ATOM 867 N ALA A 194 -5.449 5.538 -0.599 1.00 0.00 N ATOM 868 CA ALA A 194 -5.068 5.477 0.807 1.00 0.00 C ATOM 869 C ALA A 194 -3.629 4.995 0.965 1.00 0.00 C ATOM 870 O ALA A 194 -3.061 4.396 0.052 1.00 0.00 O ATOM 871 CB ALA A 194 -6.018 4.567 1.572 1.00 0.00 C ATOM 0 H ALA A 194 -4.884 4.954 -1.215 1.00 0.00 H new ATOM 0 HA ALA A 194 -5.134 6.483 1.220 1.00 0.00 H new ATOM 0 HB1 ALA A 194 -5.722 4.531 2.620 1.00 0.00 H new ATOM 0 HB2 ALA A 194 -7.034 4.954 1.495 1.00 0.00 H new ATOM 0 HB3 ALA A 194 -5.980 3.563 1.149 1.00 0.00 H new ATOM 877 N PHE A 195 -3.046 5.262 2.129 1.00 0.00 N ATOM 878 CA PHE A 195 -1.672 4.857 2.406 1.00 0.00 C ATOM 879 C PHE A 195 -1.609 3.951 3.633 1.00 0.00 C ATOM 880 O PHE A 195 -1.992 4.350 4.733 1.00 0.00 O ATOM 881 CB PHE A 195 -0.789 6.088 2.621 1.00 0.00 C ATOM 882 CG PHE A 195 -0.449 6.810 1.348 1.00 0.00 C ATOM 883 CD1 PHE A 195 0.151 6.140 0.294 1.00 0.00 C ATOM 884 CD2 PHE A 195 -0.729 8.160 1.207 1.00 0.00 C ATOM 885 CE1 PHE A 195 0.466 6.803 -0.877 1.00 0.00 C ATOM 886 CE2 PHE A 195 -0.417 8.828 0.038 1.00 0.00 C ATOM 887 CZ PHE A 195 0.180 8.148 -1.006 1.00 0.00 C ATOM 0 H PHE A 195 -3.503 5.757 2.895 1.00 0.00 H new ATOM 0 HA PHE A 195 -1.303 4.299 1.545 1.00 0.00 H new ATOM 0 HB2 PHE A 195 -1.297 6.777 3.296 1.00 0.00 H new ATOM 0 HB3 PHE A 195 0.134 5.782 3.114 1.00 0.00 H new ATOM 0 HD1 PHE A 195 0.375 5.088 0.389 1.00 0.00 H new ATOM 0 HD2 PHE A 195 -1.196 8.696 2.020 1.00 0.00 H new ATOM 0 HE1 PHE A 195 0.935 6.270 -1.690 1.00 0.00 H new ATOM 0 HE2 PHE A 195 -0.640 9.880 -0.059 1.00 0.00 H new ATOM 0 HZ PHE A 195 0.423 8.667 -1.921 1.00 0.00 H new ATOM 897 N VAL A 196 -1.123 2.730 3.435 1.00 0.00 N ATOM 898 CA VAL A 196 -1.009 1.767 4.524 1.00 0.00 C ATOM 899 C VAL A 196 0.443 1.361 4.747 1.00 0.00 C ATOM 900 O VAL A 196 1.202 1.175 3.795 1.00 0.00 O ATOM 901 CB VAL A 196 -1.847 0.505 4.247 1.00 0.00 C ATOM 902 CG1 VAL A 196 -1.876 -0.396 5.472 1.00 0.00 C ATOM 903 CG2 VAL A 196 -3.258 0.885 3.822 1.00 0.00 C ATOM 0 H VAL A 196 -0.802 2.384 2.531 1.00 0.00 H new ATOM 0 HA VAL A 196 -1.389 2.256 5.421 1.00 0.00 H new ATOM 0 HB VAL A 196 -1.382 -0.047 3.430 1.00 0.00 H new ATOM 0 HG11 VAL A 196 -2.473 -1.283 5.258 1.00 0.00 H new ATOM 0 HG12 VAL A 196 -0.860 -0.696 5.727 1.00 0.00 H new ATOM 0 HG13 VAL A 196 -2.317 0.144 6.310 1.00 0.00 H new ATOM 0 HG21 VAL A 196 -3.836 -0.019 3.630 1.00 0.00 H new ATOM 0 HG22 VAL A 196 -3.735 1.459 4.616 1.00 0.00 H new ATOM 0 HG23 VAL A 196 -3.215 1.487 2.915 1.00 0.00 H new ATOM 913 N LYS A 197 0.825 1.223 6.013 1.00 0.00 N ATOM 914 CA LYS A 197 2.187 0.836 6.364 1.00 0.00 C ATOM 915 C LYS A 197 2.206 -0.531 7.040 1.00 0.00 C ATOM 916 O LYS A 197 1.283 -0.885 7.773 1.00 0.00 O ATOM 917 CB LYS A 197 2.814 1.883 7.287 1.00 0.00 C ATOM 918 CG LYS A 197 3.369 3.090 6.549 1.00 0.00 C ATOM 919 CD LYS A 197 3.354 4.333 7.423 1.00 0.00 C ATOM 920 CE LYS A 197 2.050 5.101 7.279 1.00 0.00 C ATOM 921 NZ LYS A 197 2.171 6.499 7.776 1.00 0.00 N ATOM 0 H LYS A 197 0.210 1.373 6.813 1.00 0.00 H new ATOM 0 HA LYS A 197 2.770 0.775 5.445 1.00 0.00 H new ATOM 0 HB2 LYS A 197 2.065 2.219 8.004 1.00 0.00 H new ATOM 0 HB3 LYS A 197 3.616 1.417 7.859 1.00 0.00 H new ATOM 0 HG2 LYS A 197 4.389 2.883 6.227 1.00 0.00 H new ATOM 0 HG3 LYS A 197 2.781 3.270 5.649 1.00 0.00 H new ATOM 0 HD2 LYS A 197 3.496 4.048 8.465 1.00 0.00 H new ATOM 0 HD3 LYS A 197 4.189 4.979 7.153 1.00 0.00 H new ATOM 0 HE2 LYS A 197 1.750 5.113 6.231 1.00 0.00 H new ATOM 0 HE3 LYS A 197 1.263 4.587 7.830 1.00 0.00 H new ATOM 0 HZ1 LYS A 197 1.261 6.989 7.660 1.00 0.00 H new ATOM 0 HZ2 LYS A 197 2.433 6.488 8.782 1.00 0.00 H new ATOM 0 HZ3 LYS A 197 2.904 6.998 7.233 1.00 0.00 H new ATOM 935 N TYR A 198 3.265 -1.294 6.791 1.00 0.00 N ATOM 936 CA TYR A 198 3.404 -2.622 7.376 1.00 0.00 C ATOM 937 C TYR A 198 4.654 -2.706 8.246 1.00 0.00 C ATOM 938 O TYR A 198 5.445 -1.765 8.309 1.00 0.00 O ATOM 939 CB TYR A 198 3.463 -3.683 6.275 1.00 0.00 C ATOM 940 CG TYR A 198 2.108 -4.227 5.886 1.00 0.00 C ATOM 941 CD1 TYR A 198 1.002 -3.391 5.790 1.00 0.00 C ATOM 942 CD2 TYR A 198 1.933 -5.578 5.612 1.00 0.00 C ATOM 943 CE1 TYR A 198 -0.238 -3.885 5.435 1.00 0.00 C ATOM 944 CE2 TYR A 198 0.696 -6.080 5.254 1.00 0.00 C ATOM 945 CZ TYR A 198 -0.386 -5.230 5.168 1.00 0.00 C ATOM 946 OH TYR A 198 -1.620 -5.725 4.813 1.00 0.00 O ATOM 0 H TYR A 198 4.039 -1.015 6.188 1.00 0.00 H new ATOM 0 HA TYR A 198 2.533 -2.808 8.005 1.00 0.00 H new ATOM 0 HB2 TYR A 198 3.940 -3.254 5.394 1.00 0.00 H new ATOM 0 HB3 TYR A 198 4.094 -4.507 6.609 1.00 0.00 H new ATOM 0 HD1 TYR A 198 1.114 -2.337 5.997 1.00 0.00 H new ATOM 0 HD2 TYR A 198 2.778 -6.247 5.680 1.00 0.00 H new ATOM 0 HE1 TYR A 198 -1.087 -3.221 5.367 1.00 0.00 H new ATOM 0 HE2 TYR A 198 0.578 -7.133 5.043 1.00 0.00 H new ATOM 0 HH TYR A 198 -1.987 -6.251 5.554 1.00 0.00 H new ATOM 956 N SER A 199 4.826 -3.841 8.916 1.00 0.00 N ATOM 957 CA SER A 199 5.977 -4.048 9.786 1.00 0.00 C ATOM 958 C SER A 199 7.222 -4.384 8.970 1.00 0.00 C ATOM 959 O SER A 199 8.297 -3.830 9.199 1.00 0.00 O ATOM 960 CB SER A 199 5.692 -5.170 10.787 1.00 0.00 C ATOM 961 OG SER A 199 5.425 -6.392 10.121 1.00 0.00 O ATOM 0 H SER A 199 4.183 -4.631 8.873 1.00 0.00 H new ATOM 0 HA SER A 199 6.160 -3.122 10.331 1.00 0.00 H new ATOM 0 HB2 SER A 199 6.547 -5.294 11.452 1.00 0.00 H new ATOM 0 HB3 SER A 199 4.840 -4.898 11.410 1.00 0.00 H new ATOM 0 HG SER A 199 5.248 -7.093 10.782 1.00 0.00 H new ATOM 967 N SER A 200 7.067 -5.296 8.015 1.00 0.00 N ATOM 968 CA SER A 200 8.178 -5.710 7.166 1.00 0.00 C ATOM 969 C SER A 200 7.759 -5.738 5.699 1.00 0.00 C ATOM 970 O SER A 200 6.617 -5.424 5.361 1.00 0.00 O ATOM 971 CB SER A 200 8.685 -7.090 7.590 1.00 0.00 C ATOM 972 OG SER A 200 9.063 -7.096 8.956 1.00 0.00 O ATOM 0 H SER A 200 6.183 -5.762 7.810 1.00 0.00 H new ATOM 0 HA SER A 200 8.983 -4.984 7.282 1.00 0.00 H new ATOM 0 HB2 SER A 200 7.907 -7.835 7.421 1.00 0.00 H new ATOM 0 HB3 SER A 200 9.537 -7.374 6.972 1.00 0.00 H new ATOM 0 HG SER A 200 9.382 -7.989 9.203 1.00 0.00 H new ATOM 978 N HIS A 201 8.692 -6.117 4.831 1.00 0.00 N ATOM 979 CA HIS A 201 8.420 -6.187 3.400 1.00 0.00 C ATOM 980 C HIS A 201 7.601 -7.429 3.062 1.00 0.00 C ATOM 981 O HIS A 201 6.556 -7.339 2.419 1.00 0.00 O ATOM 982 CB HIS A 201 9.730 -6.196 2.611 1.00 0.00 C ATOM 983 CG HIS A 201 9.537 -6.111 1.128 1.00 0.00 C ATOM 984 ND1 HIS A 201 9.621 -7.206 0.294 1.00 0.00 N ATOM 985 CD2 HIS A 201 9.261 -5.053 0.330 1.00 0.00 C ATOM 986 CE1 HIS A 201 9.406 -6.826 -0.952 1.00 0.00 C ATOM 987 NE2 HIS A 201 9.185 -5.523 -0.958 1.00 0.00 N ATOM 0 H HIS A 201 9.642 -6.380 5.094 1.00 0.00 H new ATOM 0 HA HIS A 201 7.842 -5.306 3.122 1.00 0.00 H new ATOM 0 HB2 HIS A 201 10.347 -5.359 2.937 1.00 0.00 H new ATOM 0 HB3 HIS A 201 10.280 -7.107 2.846 1.00 0.00 H new ATOM 0 HD2 HIS A 201 9.126 -4.030 0.647 1.00 0.00 H new ATOM 0 HE1 HIS A 201 9.410 -7.470 -1.819 1.00 0.00 H new ATOM 0 HE2 HIS A 201 8.990 -4.958 -1.785 1.00 0.00 H new ATOM 995 N ALA A 202 8.084 -8.587 3.501 1.00 0.00 N ATOM 996 CA ALA A 202 7.396 -9.847 3.246 1.00 0.00 C ATOM 997 C ALA A 202 5.886 -9.684 3.379 1.00 0.00 C ATOM 998 O ALA A 202 5.151 -9.810 2.401 1.00 0.00 O ATOM 999 CB ALA A 202 7.899 -10.924 4.196 1.00 0.00 C ATOM 0 H ALA A 202 8.948 -8.679 4.035 1.00 0.00 H new ATOM 0 HA ALA A 202 7.613 -10.151 2.222 1.00 0.00 H new ATOM 0 HB1 ALA A 202 7.377 -11.859 3.995 1.00 0.00 H new ATOM 0 HB2 ALA A 202 8.970 -11.067 4.050 1.00 0.00 H new ATOM 0 HB3 ALA A 202 7.711 -10.618 5.225 1.00 0.00 H new ATOM 1005 N GLU A 203 5.430 -9.405 4.597 1.00 0.00 N ATOM 1006 CA GLU A 203 4.007 -9.227 4.857 1.00 0.00 C ATOM 1007 C GLU A 203 3.376 -8.302 3.820 1.00 0.00 C ATOM 1008 O GLU A 203 2.288 -8.572 3.311 1.00 0.00 O ATOM 1009 CB GLU A 203 3.789 -8.661 6.261 1.00 0.00 C ATOM 1010 CG GLU A 203 3.892 -9.704 7.361 1.00 0.00 C ATOM 1011 CD GLU A 203 2.935 -10.863 7.158 1.00 0.00 C ATOM 1012 OE1 GLU A 203 1.858 -10.644 6.563 1.00 0.00 O ATOM 1013 OE2 GLU A 203 3.262 -11.986 7.593 1.00 0.00 O ATOM 0 H GLU A 203 6.026 -9.298 5.418 1.00 0.00 H new ATOM 0 HA GLU A 203 3.527 -10.203 4.788 1.00 0.00 H new ATOM 0 HB2 GLU A 203 4.523 -7.877 6.446 1.00 0.00 H new ATOM 0 HB3 GLU A 203 2.805 -8.193 6.306 1.00 0.00 H new ATOM 0 HG2 GLU A 203 4.913 -10.084 7.402 1.00 0.00 H new ATOM 0 HG3 GLU A 203 3.688 -9.234 8.323 1.00 0.00 H new ATOM 1020 N ALA A 204 4.067 -7.209 3.513 1.00 0.00 N ATOM 1021 CA ALA A 204 3.576 -6.244 2.536 1.00 0.00 C ATOM 1022 C ALA A 204 3.194 -6.931 1.230 1.00 0.00 C ATOM 1023 O ALA A 204 2.075 -6.777 0.741 1.00 0.00 O ATOM 1024 CB ALA A 204 4.623 -5.170 2.284 1.00 0.00 C ATOM 0 H ALA A 204 4.968 -6.970 3.926 1.00 0.00 H new ATOM 0 HA ALA A 204 2.681 -5.774 2.944 1.00 0.00 H new ATOM 0 HB1 ALA A 204 4.243 -4.456 1.553 1.00 0.00 H new ATOM 0 HB2 ALA A 204 4.844 -4.651 3.217 1.00 0.00 H new ATOM 0 HB3 ALA A 204 5.533 -5.632 1.902 1.00 0.00 H new ATOM 1030 N GLN A 205 4.131 -7.689 0.669 1.00 0.00 N ATOM 1031 CA GLN A 205 3.892 -8.398 -0.582 1.00 0.00 C ATOM 1032 C GLN A 205 2.678 -9.313 -0.466 1.00 0.00 C ATOM 1033 O GLN A 205 1.864 -9.401 -1.385 1.00 0.00 O ATOM 1034 CB GLN A 205 5.125 -9.214 -0.975 1.00 0.00 C ATOM 1035 CG GLN A 205 5.068 -9.759 -2.392 1.00 0.00 C ATOM 1036 CD GLN A 205 5.428 -8.718 -3.433 1.00 0.00 C ATOM 1037 OE1 GLN A 205 6.605 -8.466 -3.695 1.00 0.00 O ATOM 1038 NE2 GLN A 205 4.415 -8.105 -4.034 1.00 0.00 N ATOM 0 H GLN A 205 5.062 -7.828 1.061 1.00 0.00 H new ATOM 0 HA GLN A 205 3.693 -7.658 -1.357 1.00 0.00 H new ATOM 0 HB2 GLN A 205 6.012 -8.589 -0.870 1.00 0.00 H new ATOM 0 HB3 GLN A 205 5.237 -10.046 -0.279 1.00 0.00 H new ATOM 0 HG2 GLN A 205 5.749 -10.605 -2.479 1.00 0.00 H new ATOM 0 HG3 GLN A 205 4.065 -10.136 -2.592 1.00 0.00 H new ATOM 0 HE21 GLN A 205 3.455 -8.344 -3.787 1.00 0.00 H new ATOM 0 HE22 GLN A 205 4.597 -7.395 -4.743 1.00 0.00 H new ATOM 1047 N ALA A 206 2.563 -9.994 0.670 1.00 0.00 N ATOM 1048 CA ALA A 206 1.447 -10.901 0.907 1.00 0.00 C ATOM 1049 C ALA A 206 0.112 -10.201 0.678 1.00 0.00 C ATOM 1050 O ALA A 206 -0.751 -10.709 -0.037 1.00 0.00 O ATOM 1051 CB ALA A 206 1.515 -11.463 2.320 1.00 0.00 C ATOM 0 H ALA A 206 3.229 -9.934 1.440 1.00 0.00 H new ATOM 0 HA ALA A 206 1.522 -11.724 0.196 1.00 0.00 H new ATOM 0 HB1 ALA A 206 0.676 -12.139 2.484 1.00 0.00 H new ATOM 0 HB2 ALA A 206 2.450 -12.008 2.450 1.00 0.00 H new ATOM 0 HB3 ALA A 206 1.468 -10.645 3.039 1.00 0.00 H new ATOM 1057 N ALA A 207 -0.052 -9.033 1.291 1.00 0.00 N ATOM 1058 CA ALA A 207 -1.282 -8.264 1.152 1.00 0.00 C ATOM 1059 C ALA A 207 -1.435 -7.725 -0.266 1.00 0.00 C ATOM 1060 O ALA A 207 -2.550 -7.490 -0.734 1.00 0.00 O ATOM 1061 CB ALA A 207 -1.306 -7.123 2.158 1.00 0.00 C ATOM 0 H ALA A 207 0.652 -8.599 1.888 1.00 0.00 H new ATOM 0 HA ALA A 207 -2.122 -8.929 1.352 1.00 0.00 H new ATOM 0 HB1 ALA A 207 -2.230 -6.556 2.044 1.00 0.00 H new ATOM 0 HB2 ALA A 207 -1.251 -7.528 3.169 1.00 0.00 H new ATOM 0 HB3 ALA A 207 -0.454 -6.466 1.984 1.00 0.00 H new ATOM 1067 N ILE A 208 -0.309 -7.530 -0.945 1.00 0.00 N ATOM 1068 CA ILE A 208 -0.320 -7.018 -2.310 1.00 0.00 C ATOM 1069 C ILE A 208 -0.852 -8.064 -3.284 1.00 0.00 C ATOM 1070 O ILE A 208 -1.906 -7.881 -3.891 1.00 0.00 O ATOM 1071 CB ILE A 208 1.088 -6.584 -2.759 1.00 0.00 C ATOM 1072 CG1 ILE A 208 1.528 -5.334 -1.994 1.00 0.00 C ATOM 1073 CG2 ILE A 208 1.110 -6.329 -4.259 1.00 0.00 C ATOM 1074 CD1 ILE A 208 3.022 -5.103 -2.022 1.00 0.00 C ATOM 0 H ILE A 208 0.622 -7.719 -0.572 1.00 0.00 H new ATOM 0 HA ILE A 208 -0.979 -6.150 -2.317 1.00 0.00 H new ATOM 0 HB ILE A 208 1.789 -7.389 -2.537 1.00 0.00 H new ATOM 0 HG12 ILE A 208 1.026 -4.464 -2.417 1.00 0.00 H new ATOM 0 HG13 ILE A 208 1.201 -5.418 -0.958 1.00 0.00 H new ATOM 0 HG21 ILE A 208 2.112 -6.023 -4.561 1.00 0.00 H new ATOM 0 HG22 ILE A 208 0.834 -7.242 -4.787 1.00 0.00 H new ATOM 0 HG23 ILE A 208 0.400 -5.539 -4.504 1.00 0.00 H new ATOM 0 HD11 ILE A 208 3.261 -4.200 -1.460 1.00 0.00 H new ATOM 0 HD12 ILE A 208 3.531 -5.956 -1.572 1.00 0.00 H new ATOM 0 HD13 ILE A 208 3.353 -4.986 -3.054 1.00 0.00 H new ATOM 1086 N ASN A 209 -0.116 -9.161 -3.427 1.00 0.00 N ATOM 1087 CA ASN A 209 -0.515 -10.237 -4.327 1.00 0.00 C ATOM 1088 C ASN A 209 -1.860 -10.824 -3.910 1.00 0.00 C ATOM 1089 O ASN A 209 -2.686 -11.169 -4.755 1.00 0.00 O ATOM 1090 CB ASN A 209 0.550 -11.336 -4.344 1.00 0.00 C ATOM 1091 CG ASN A 209 0.145 -12.520 -5.200 1.00 0.00 C ATOM 1092 OD1 ASN A 209 -0.899 -13.134 -4.976 1.00 0.00 O ATOM 1093 ND2 ASN A 209 0.970 -12.847 -6.188 1.00 0.00 N ATOM 0 H ASN A 209 0.760 -9.328 -2.931 1.00 0.00 H new ATOM 0 HA ASN A 209 -0.615 -9.821 -5.329 1.00 0.00 H new ATOM 0 HB2 ASN A 209 1.487 -10.924 -4.718 1.00 0.00 H new ATOM 0 HB3 ASN A 209 0.735 -11.675 -3.325 1.00 0.00 H new ATOM 0 HD21 ASN A 209 0.749 -13.635 -6.797 1.00 0.00 H new ATOM 0 HD22 ASN A 209 1.825 -12.311 -6.338 1.00 0.00 H new ATOM 1100 N ALA A 210 -2.073 -10.934 -2.603 1.00 0.00 N ATOM 1101 CA ALA A 210 -3.318 -11.476 -2.075 1.00 0.00 C ATOM 1102 C ALA A 210 -4.499 -10.574 -2.418 1.00 0.00 C ATOM 1103 O ALA A 210 -5.637 -11.034 -2.515 1.00 0.00 O ATOM 1104 CB ALA A 210 -3.215 -11.664 -0.568 1.00 0.00 C ATOM 0 H ALA A 210 -1.399 -10.655 -1.890 1.00 0.00 H new ATOM 0 HA ALA A 210 -3.489 -12.447 -2.540 1.00 0.00 H new ATOM 0 HB1 ALA A 210 -4.152 -12.070 -0.187 1.00 0.00 H new ATOM 0 HB2 ALA A 210 -2.402 -12.355 -0.342 1.00 0.00 H new ATOM 0 HB3 ALA A 210 -3.016 -10.703 -0.094 1.00 0.00 H new ATOM 1110 N LEU A 211 -4.221 -9.288 -2.599 1.00 0.00 N ATOM 1111 CA LEU A 211 -5.261 -8.320 -2.931 1.00 0.00 C ATOM 1112 C LEU A 211 -5.032 -7.728 -4.318 1.00 0.00 C ATOM 1113 O LEU A 211 -5.723 -8.077 -5.276 1.00 0.00 O ATOM 1114 CB LEU A 211 -5.298 -7.203 -1.887 1.00 0.00 C ATOM 1115 CG LEU A 211 -5.613 -7.634 -0.454 1.00 0.00 C ATOM 1116 CD1 LEU A 211 -5.470 -6.458 0.500 1.00 0.00 C ATOM 1117 CD2 LEU A 211 -7.013 -8.224 -0.370 1.00 0.00 C ATOM 0 H LEU A 211 -3.285 -8.891 -2.522 1.00 0.00 H new ATOM 0 HA LEU A 211 -6.219 -8.840 -2.932 1.00 0.00 H new ATOM 0 HB2 LEU A 211 -4.332 -6.699 -1.889 1.00 0.00 H new ATOM 0 HB3 LEU A 211 -6.042 -6.469 -2.196 1.00 0.00 H new ATOM 0 HG LEU A 211 -4.898 -8.403 -0.161 1.00 0.00 H new ATOM 0 HD11 LEU A 211 -5.698 -6.783 1.515 1.00 0.00 H new ATOM 0 HD12 LEU A 211 -4.448 -6.080 0.461 1.00 0.00 H new ATOM 0 HD13 LEU A 211 -6.161 -5.667 0.209 1.00 0.00 H new ATOM 0 HD21 LEU A 211 -7.220 -8.525 0.657 1.00 0.00 H new ATOM 0 HD22 LEU A 211 -7.742 -7.477 -0.683 1.00 0.00 H new ATOM 0 HD23 LEU A 211 -7.081 -9.093 -1.024 1.00 0.00 H new ATOM 1129 N HIS A 212 -4.055 -6.832 -4.419 1.00 0.00 N ATOM 1130 CA HIS A 212 -3.732 -6.193 -5.690 1.00 0.00 C ATOM 1131 C HIS A 212 -3.620 -7.228 -6.805 1.00 0.00 C ATOM 1132 O HIS A 212 -2.908 -8.223 -6.673 1.00 0.00 O ATOM 1133 CB HIS A 212 -2.425 -5.409 -5.573 1.00 0.00 C ATOM 1134 CG HIS A 212 -1.776 -5.127 -6.893 1.00 0.00 C ATOM 1135 ND1 HIS A 212 -2.353 -4.332 -7.861 1.00 0.00 N ATOM 1136 CD2 HIS A 212 -0.591 -5.537 -7.402 1.00 0.00 C ATOM 1137 CE1 HIS A 212 -1.551 -4.268 -8.909 1.00 0.00 C ATOM 1138 NE2 HIS A 212 -0.475 -4.990 -8.656 1.00 0.00 N ATOM 0 H HIS A 212 -3.474 -6.532 -3.636 1.00 0.00 H new ATOM 0 HA HIS A 212 -4.539 -5.504 -5.938 1.00 0.00 H new ATOM 0 HB2 HIS A 212 -2.621 -4.465 -5.065 1.00 0.00 H new ATOM 0 HB3 HIS A 212 -1.730 -5.969 -4.948 1.00 0.00 H new ATOM 0 HD1 HIS A 212 -3.257 -3.866 -7.780 1.00 0.00 H new ATOM 0 HD2 HIS A 212 0.129 -6.176 -6.913 1.00 0.00 H new ATOM 0 HE1 HIS A 212 -1.743 -3.718 -9.819 1.00 0.00 H new ATOM 1146 N GLY A 213 -4.329 -6.987 -7.904 1.00 0.00 N ATOM 1147 CA GLY A 213 -4.296 -7.908 -9.025 1.00 0.00 C ATOM 1148 C GLY A 213 -5.252 -9.071 -8.849 1.00 0.00 C ATOM 1149 O GLY A 213 -5.653 -9.707 -9.824 1.00 0.00 O ATOM 0 H GLY A 213 -4.925 -6.170 -8.038 1.00 0.00 H new ATOM 0 HA2 GLY A 213 -4.547 -7.371 -9.940 1.00 0.00 H new ATOM 0 HA3 GLY A 213 -3.283 -8.290 -9.147 1.00 0.00 H new ATOM 1153 N SER A 214 -5.618 -9.351 -7.602 1.00 0.00 N ATOM 1154 CA SER A 214 -6.529 -10.449 -7.301 1.00 0.00 C ATOM 1155 C SER A 214 -7.978 -9.972 -7.311 1.00 0.00 C ATOM 1156 O SER A 214 -8.742 -10.297 -8.219 1.00 0.00 O ATOM 1157 CB SER A 214 -6.191 -11.061 -5.940 1.00 0.00 C ATOM 1158 OG SER A 214 -5.106 -11.967 -6.043 1.00 0.00 O ATOM 0 H SER A 214 -5.298 -8.833 -6.784 1.00 0.00 H new ATOM 0 HA SER A 214 -6.410 -11.209 -8.073 1.00 0.00 H new ATOM 0 HB2 SER A 214 -5.942 -10.269 -5.234 1.00 0.00 H new ATOM 0 HB3 SER A 214 -7.065 -11.579 -5.544 1.00 0.00 H new ATOM 0 HG SER A 214 -4.333 -11.608 -5.559 1.00 0.00 H new ATOM 1164 N GLN A 215 -8.346 -9.198 -6.295 1.00 0.00 N ATOM 1165 CA GLN A 215 -9.704 -8.676 -6.186 1.00 0.00 C ATOM 1166 C GLN A 215 -9.833 -7.342 -6.913 1.00 0.00 C ATOM 1167 O GLN A 215 -8.848 -6.629 -7.106 1.00 0.00 O ATOM 1168 CB GLN A 215 -10.093 -8.510 -4.717 1.00 0.00 C ATOM 1169 CG GLN A 215 -11.088 -7.388 -4.474 1.00 0.00 C ATOM 1170 CD GLN A 215 -11.737 -7.468 -3.106 1.00 0.00 C ATOM 1171 OE1 GLN A 215 -11.784 -6.483 -2.369 1.00 0.00 O ATOM 1172 NE2 GLN A 215 -12.242 -8.646 -2.759 1.00 0.00 N ATOM 0 H GLN A 215 -7.724 -8.919 -5.536 1.00 0.00 H new ATOM 0 HA GLN A 215 -10.380 -9.391 -6.654 1.00 0.00 H new ATOM 0 HB2 GLN A 215 -10.518 -9.446 -4.354 1.00 0.00 H new ATOM 0 HB3 GLN A 215 -9.194 -8.320 -4.131 1.00 0.00 H new ATOM 0 HG2 GLN A 215 -10.580 -6.429 -4.575 1.00 0.00 H new ATOM 0 HG3 GLN A 215 -11.862 -7.421 -5.241 1.00 0.00 H new ATOM 0 HE21 GLN A 215 -12.181 -9.436 -3.401 1.00 0.00 H new ATOM 0 HE22 GLN A 215 -12.691 -8.761 -1.850 1.00 0.00 H new ATOM 1181 N THR A 216 -11.056 -7.008 -7.314 1.00 0.00 N ATOM 1182 CA THR A 216 -11.315 -5.760 -8.021 1.00 0.00 C ATOM 1183 C THR A 216 -12.291 -4.882 -7.246 1.00 0.00 C ATOM 1184 O THR A 216 -13.437 -5.265 -7.016 1.00 0.00 O ATOM 1185 CB THR A 216 -11.882 -6.019 -9.429 1.00 0.00 C ATOM 1186 OG1 THR A 216 -11.256 -7.171 -10.005 1.00 0.00 O ATOM 1187 CG2 THR A 216 -11.663 -4.813 -10.331 1.00 0.00 C ATOM 0 H THR A 216 -11.883 -7.585 -7.161 1.00 0.00 H new ATOM 0 HA THR A 216 -10.359 -5.244 -8.112 1.00 0.00 H new ATOM 0 HB THR A 216 -12.954 -6.195 -9.338 1.00 0.00 H new ATOM 0 HG1 THR A 216 -11.623 -7.330 -10.900 1.00 0.00 H new ATOM 0 HG21 THR A 216 -12.072 -5.019 -11.320 1.00 0.00 H new ATOM 0 HG22 THR A 216 -12.165 -3.944 -9.905 1.00 0.00 H new ATOM 0 HG23 THR A 216 -10.595 -4.610 -10.415 1.00 0.00 H new ATOM 1195 N MET A 217 -11.829 -3.701 -6.847 1.00 0.00 N ATOM 1196 CA MET A 217 -12.663 -2.768 -6.099 1.00 0.00 C ATOM 1197 C MET A 217 -14.031 -2.615 -6.756 1.00 0.00 C ATOM 1198 O MET A 217 -14.152 -2.507 -7.976 1.00 0.00 O ATOM 1199 CB MET A 217 -11.977 -1.404 -6.000 1.00 0.00 C ATOM 1200 CG MET A 217 -10.856 -1.361 -4.973 1.00 0.00 C ATOM 1201 SD MET A 217 -11.454 -1.556 -3.284 1.00 0.00 S ATOM 1202 CE MET A 217 -10.475 -2.952 -2.737 1.00 0.00 C ATOM 0 H MET A 217 -10.882 -3.368 -7.029 1.00 0.00 H new ATOM 0 HA MET A 217 -12.804 -3.170 -5.096 1.00 0.00 H new ATOM 0 HB2 MET A 217 -11.574 -1.137 -6.977 1.00 0.00 H new ATOM 0 HB3 MET A 217 -12.721 -0.650 -5.745 1.00 0.00 H new ATOM 0 HG2 MET A 217 -10.137 -2.150 -5.193 1.00 0.00 H new ATOM 0 HG3 MET A 217 -10.326 -0.413 -5.059 1.00 0.00 H new ATOM 0 HE1 MET A 217 -11.114 -3.661 -2.210 1.00 0.00 H new ATOM 0 HE2 MET A 217 -10.025 -3.441 -3.601 1.00 0.00 H new ATOM 0 HE3 MET A 217 -9.689 -2.605 -2.066 1.00 0.00 H new ATOM 1212 N PRO A 218 -15.088 -2.606 -5.930 1.00 0.00 N ATOM 1213 CA PRO A 218 -16.466 -2.467 -6.409 1.00 0.00 C ATOM 1214 C PRO A 218 -16.627 -1.307 -7.385 1.00 0.00 C ATOM 1215 O PRO A 218 -16.473 -0.144 -7.012 1.00 0.00 O ATOM 1216 CB PRO A 218 -17.262 -2.203 -5.128 1.00 0.00 C ATOM 1217 CG PRO A 218 -16.466 -2.849 -4.047 1.00 0.00 C ATOM 1218 CD PRO A 218 -15.018 -2.731 -4.464 1.00 0.00 C ATOM 0 HA PRO A 218 -16.797 -3.348 -6.959 1.00 0.00 H new ATOM 0 HB2 PRO A 218 -17.380 -1.134 -4.948 1.00 0.00 H new ATOM 0 HB3 PRO A 218 -18.264 -2.628 -5.190 1.00 0.00 H new ATOM 0 HG2 PRO A 218 -16.637 -2.356 -3.090 1.00 0.00 H new ATOM 0 HG3 PRO A 218 -16.752 -3.894 -3.924 1.00 0.00 H new ATOM 0 HD2 PRO A 218 -14.540 -1.863 -4.010 1.00 0.00 H new ATOM 0 HD3 PRO A 218 -14.442 -3.606 -4.163 1.00 0.00 H new ATOM 1226 N GLY A 219 -16.936 -1.630 -8.637 1.00 0.00 N ATOM 1227 CA GLY A 219 -17.112 -0.603 -9.646 1.00 0.00 C ATOM 1228 C GLY A 219 -16.033 -0.644 -10.710 1.00 0.00 C ATOM 1229 O GLY A 219 -16.329 -0.720 -11.902 1.00 0.00 O ATOM 0 H GLY A 219 -17.068 -2.585 -8.970 1.00 0.00 H new ATOM 0 HA2 GLY A 219 -18.087 -0.724 -10.117 1.00 0.00 H new ATOM 0 HA3 GLY A 219 -17.109 0.376 -9.167 1.00 0.00 H new ATOM 1233 N ALA A 220 -14.777 -0.591 -10.278 1.00 0.00 N ATOM 1234 CA ALA A 220 -13.650 -0.624 -11.202 1.00 0.00 C ATOM 1235 C ALA A 220 -13.597 -1.947 -11.958 1.00 0.00 C ATOM 1236 O ALA A 220 -13.941 -2.997 -11.416 1.00 0.00 O ATOM 1237 CB ALA A 220 -12.346 -0.390 -10.452 1.00 0.00 C ATOM 0 H ALA A 220 -14.515 -0.525 -9.295 1.00 0.00 H new ATOM 0 HA ALA A 220 -13.787 0.175 -11.931 1.00 0.00 H new ATOM 0 HB1 ALA A 220 -11.513 -0.417 -11.154 1.00 0.00 H new ATOM 0 HB2 ALA A 220 -12.377 0.584 -9.963 1.00 0.00 H new ATOM 0 HB3 ALA A 220 -12.213 -1.169 -9.701 1.00 0.00 H new ATOM 1243 N SER A 221 -13.166 -1.888 -13.214 1.00 0.00 N ATOM 1244 CA SER A 221 -13.074 -3.082 -14.047 1.00 0.00 C ATOM 1245 C SER A 221 -11.677 -3.691 -13.969 1.00 0.00 C ATOM 1246 O SER A 221 -11.468 -4.843 -14.348 1.00 0.00 O ATOM 1247 CB SER A 221 -13.415 -2.744 -15.499 1.00 0.00 C ATOM 1248 OG SER A 221 -13.323 -3.892 -16.325 1.00 0.00 O ATOM 0 H SER A 221 -12.875 -1.027 -13.677 1.00 0.00 H new ATOM 0 HA SER A 221 -13.792 -3.812 -13.674 1.00 0.00 H new ATOM 0 HB2 SER A 221 -14.423 -2.333 -15.553 1.00 0.00 H new ATOM 0 HB3 SER A 221 -12.737 -1.973 -15.865 1.00 0.00 H new ATOM 0 HG SER A 221 -12.721 -4.545 -15.911 1.00 0.00 H new ATOM 1254 N SER A 222 -10.723 -2.908 -13.476 1.00 0.00 N ATOM 1255 CA SER A 222 -9.345 -3.367 -13.352 1.00 0.00 C ATOM 1256 C SER A 222 -9.042 -3.794 -11.919 1.00 0.00 C ATOM 1257 O SER A 222 -9.429 -3.122 -10.963 1.00 0.00 O ATOM 1258 CB SER A 222 -8.376 -2.264 -13.783 1.00 0.00 C ATOM 1259 OG SER A 222 -8.123 -2.324 -15.175 1.00 0.00 O ATOM 0 H SER A 222 -10.879 -1.952 -13.156 1.00 0.00 H new ATOM 0 HA SER A 222 -9.216 -4.230 -14.005 1.00 0.00 H new ATOM 0 HB2 SER A 222 -8.792 -1.290 -13.527 1.00 0.00 H new ATOM 0 HB3 SER A 222 -7.439 -2.364 -13.235 1.00 0.00 H new ATOM 0 HG SER A 222 -7.503 -1.608 -15.426 1.00 0.00 H new ATOM 1265 N SER A 223 -8.346 -4.918 -11.778 1.00 0.00 N ATOM 1266 CA SER A 223 -7.993 -5.439 -10.462 1.00 0.00 C ATOM 1267 C SER A 223 -7.475 -4.324 -9.558 1.00 0.00 C ATOM 1268 O SER A 223 -7.104 -3.248 -10.029 1.00 0.00 O ATOM 1269 CB SER A 223 -6.937 -6.538 -10.591 1.00 0.00 C ATOM 1270 OG SER A 223 -6.024 -6.248 -11.636 1.00 0.00 O ATOM 0 H SER A 223 -8.015 -5.485 -12.559 1.00 0.00 H new ATOM 0 HA SER A 223 -8.892 -5.860 -10.012 1.00 0.00 H new ATOM 0 HB2 SER A 223 -6.397 -6.640 -9.650 1.00 0.00 H new ATOM 0 HB3 SER A 223 -7.424 -7.494 -10.784 1.00 0.00 H new ATOM 0 HG SER A 223 -5.571 -7.072 -11.912 1.00 0.00 H new ATOM 1276 N LEU A 224 -7.454 -4.589 -8.256 1.00 0.00 N ATOM 1277 CA LEU A 224 -6.982 -3.610 -7.283 1.00 0.00 C ATOM 1278 C LEU A 224 -5.556 -3.172 -7.600 1.00 0.00 C ATOM 1279 O LEU A 224 -4.808 -3.889 -8.264 1.00 0.00 O ATOM 1280 CB LEU A 224 -7.048 -4.192 -5.871 1.00 0.00 C ATOM 1281 CG LEU A 224 -6.415 -3.345 -4.766 1.00 0.00 C ATOM 1282 CD1 LEU A 224 -7.174 -2.039 -4.594 1.00 0.00 C ATOM 1283 CD2 LEU A 224 -6.379 -4.119 -3.456 1.00 0.00 C ATOM 0 H LEU A 224 -7.758 -5.474 -7.850 1.00 0.00 H new ATOM 0 HA LEU A 224 -7.631 -2.736 -7.339 1.00 0.00 H new ATOM 0 HB2 LEU A 224 -8.095 -4.361 -5.618 1.00 0.00 H new ATOM 0 HB3 LEU A 224 -6.561 -5.167 -5.878 1.00 0.00 H new ATOM 0 HG LEU A 224 -5.391 -3.111 -5.055 1.00 0.00 H new ATOM 0 HD11 LEU A 224 -6.709 -1.450 -3.804 1.00 0.00 H new ATOM 0 HD12 LEU A 224 -7.149 -1.478 -5.528 1.00 0.00 H new ATOM 0 HD13 LEU A 224 -8.209 -2.252 -4.327 1.00 0.00 H new ATOM 0 HD21 LEU A 224 -5.925 -3.501 -2.681 1.00 0.00 H new ATOM 0 HD22 LEU A 224 -7.395 -4.383 -3.161 1.00 0.00 H new ATOM 0 HD23 LEU A 224 -5.791 -5.028 -3.586 1.00 0.00 H new ATOM 1295 N VAL A 225 -5.184 -1.991 -7.117 1.00 0.00 N ATOM 1296 CA VAL A 225 -3.846 -1.458 -7.345 1.00 0.00 C ATOM 1297 C VAL A 225 -3.164 -1.103 -6.029 1.00 0.00 C ATOM 1298 O VAL A 225 -3.552 -0.149 -5.354 1.00 0.00 O ATOM 1299 CB VAL A 225 -3.884 -0.209 -8.245 1.00 0.00 C ATOM 1300 CG1 VAL A 225 -2.489 0.374 -8.410 1.00 0.00 C ATOM 1301 CG2 VAL A 225 -4.494 -0.545 -9.597 1.00 0.00 C ATOM 0 H VAL A 225 -5.791 -1.385 -6.565 1.00 0.00 H new ATOM 0 HA VAL A 225 -3.276 -2.240 -7.847 1.00 0.00 H new ATOM 0 HB VAL A 225 -4.511 0.543 -7.766 1.00 0.00 H new ATOM 0 HG11 VAL A 225 -2.536 1.256 -9.049 1.00 0.00 H new ATOM 0 HG12 VAL A 225 -2.094 0.654 -7.434 1.00 0.00 H new ATOM 0 HG13 VAL A 225 -1.835 -0.370 -8.866 1.00 0.00 H new ATOM 0 HG21 VAL A 225 -4.513 0.349 -10.220 1.00 0.00 H new ATOM 0 HG22 VAL A 225 -3.896 -1.315 -10.085 1.00 0.00 H new ATOM 0 HG23 VAL A 225 -5.511 -0.911 -9.456 1.00 0.00 H new ATOM 1311 N VAL A 226 -2.145 -1.876 -5.668 1.00 0.00 N ATOM 1312 CA VAL A 226 -1.407 -1.642 -4.433 1.00 0.00 C ATOM 1313 C VAL A 226 0.096 -1.766 -4.658 1.00 0.00 C ATOM 1314 O VAL A 226 0.625 -2.868 -4.798 1.00 0.00 O ATOM 1315 CB VAL A 226 -1.832 -2.628 -3.329 1.00 0.00 C ATOM 1316 CG1 VAL A 226 -1.123 -2.307 -2.023 1.00 0.00 C ATOM 1317 CG2 VAL A 226 -3.342 -2.603 -3.146 1.00 0.00 C ATOM 0 H VAL A 226 -1.812 -2.670 -6.214 1.00 0.00 H new ATOM 0 HA VAL A 226 -1.641 -0.627 -4.113 1.00 0.00 H new ATOM 0 HB VAL A 226 -1.542 -3.634 -3.633 1.00 0.00 H new ATOM 0 HG11 VAL A 226 -1.436 -3.015 -1.255 1.00 0.00 H new ATOM 0 HG12 VAL A 226 -0.045 -2.381 -2.166 1.00 0.00 H new ATOM 0 HG13 VAL A 226 -1.379 -1.295 -1.710 1.00 0.00 H new ATOM 0 HG21 VAL A 226 -3.625 -3.306 -2.362 1.00 0.00 H new ATOM 0 HG22 VAL A 226 -3.658 -1.598 -2.864 1.00 0.00 H new ATOM 0 HG23 VAL A 226 -3.826 -2.887 -4.080 1.00 0.00 H new ATOM 1327 N LYS A 227 0.779 -0.627 -4.692 1.00 0.00 N ATOM 1328 CA LYS A 227 2.223 -0.606 -4.898 1.00 0.00 C ATOM 1329 C LYS A 227 2.904 0.308 -3.885 1.00 0.00 C ATOM 1330 O LYS A 227 2.349 1.332 -3.486 1.00 0.00 O ATOM 1331 CB LYS A 227 2.548 -0.142 -6.320 1.00 0.00 C ATOM 1332 CG LYS A 227 1.846 1.146 -6.715 1.00 0.00 C ATOM 1333 CD LYS A 227 1.634 1.226 -8.218 1.00 0.00 C ATOM 1334 CE LYS A 227 2.852 1.804 -8.922 1.00 0.00 C ATOM 1335 NZ LYS A 227 2.900 1.411 -10.358 1.00 0.00 N ATOM 0 H LYS A 227 0.356 0.294 -4.580 1.00 0.00 H new ATOM 0 HA LYS A 227 2.600 -1.619 -4.757 1.00 0.00 H new ATOM 0 HB2 LYS A 227 3.625 -0.001 -6.410 1.00 0.00 H new ATOM 0 HB3 LYS A 227 2.270 -0.928 -7.022 1.00 0.00 H new ATOM 0 HG2 LYS A 227 0.884 1.208 -6.207 1.00 0.00 H new ATOM 0 HG3 LYS A 227 2.437 2.000 -6.384 1.00 0.00 H new ATOM 0 HD2 LYS A 227 1.424 0.231 -8.610 1.00 0.00 H new ATOM 0 HD3 LYS A 227 0.762 1.844 -8.431 1.00 0.00 H new ATOM 0 HE2 LYS A 227 2.835 2.891 -8.843 1.00 0.00 H new ATOM 0 HE3 LYS A 227 3.758 1.462 -8.421 1.00 0.00 H new ATOM 0 HZ1 LYS A 227 3.744 1.824 -10.803 1.00 0.00 H new ATOM 0 HZ2 LYS A 227 2.941 0.375 -10.433 1.00 0.00 H new ATOM 0 HZ3 LYS A 227 2.048 1.759 -10.842 1.00 0.00 H new ATOM 1349 N PHE A 228 4.110 -0.068 -3.473 1.00 0.00 N ATOM 1350 CA PHE A 228 4.868 0.719 -2.507 1.00 0.00 C ATOM 1351 C PHE A 228 4.953 2.179 -2.941 1.00 0.00 C ATOM 1352 O PHE A 228 5.046 2.479 -4.131 1.00 0.00 O ATOM 1353 CB PHE A 228 6.275 0.142 -2.339 1.00 0.00 C ATOM 1354 CG PHE A 228 6.297 -1.353 -2.201 1.00 0.00 C ATOM 1355 CD1 PHE A 228 6.016 -1.954 -0.984 1.00 0.00 C ATOM 1356 CD2 PHE A 228 6.600 -2.158 -3.287 1.00 0.00 C ATOM 1357 CE1 PHE A 228 6.036 -3.330 -0.853 1.00 0.00 C ATOM 1358 CE2 PHE A 228 6.620 -3.535 -3.163 1.00 0.00 C ATOM 1359 CZ PHE A 228 6.339 -4.121 -1.944 1.00 0.00 C ATOM 0 H PHE A 228 4.584 -0.913 -3.793 1.00 0.00 H new ATOM 0 HA PHE A 228 4.347 0.673 -1.550 1.00 0.00 H new ATOM 0 HB2 PHE A 228 6.882 0.429 -3.198 1.00 0.00 H new ATOM 0 HB3 PHE A 228 6.739 0.587 -1.459 1.00 0.00 H new ATOM 0 HD1 PHE A 228 5.779 -1.340 -0.128 1.00 0.00 H new ATOM 0 HD2 PHE A 228 6.823 -1.705 -4.242 1.00 0.00 H new ATOM 0 HE1 PHE A 228 5.815 -3.786 0.101 1.00 0.00 H new ATOM 0 HE2 PHE A 228 6.855 -4.152 -4.018 1.00 0.00 H new ATOM 0 HZ PHE A 228 6.356 -5.196 -1.844 1.00 0.00 H new